A1CVC

1-[4-(1H-imidazol-1-yl)phenyl]ethan-1-one

Created:	2025-09-23
Last modified:	2026-02-18

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1 entries where A1CVC is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	24
Chiral Atom Count	0
Bond Count	25
Aromatic Bond Count	11

2D diagram of A1CVC

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Chemical Component Summary
Name	1-[4-(1H-imidazol-1-yl)phenyl]ethan-1-one
Systematic Name (OpenEye OEToolkits)	1-(4-imidazol-1-ylphenyl)ethanone
Formula	C₁₁ H₁₀ N₂ O
Molecular Weight	186.21
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	14.52	CC(=O)c1ccc(cc1)n1ccnc1
SMILES	CACTVS	3.385	CC(=O)c1ccc(cc1)n2ccnc2
SMILES	OpenEye OEToolkits	3.1.0.0	CC(=O)c1ccc(cc1)n2ccnc2
Canonical SMILES	CACTVS	3.385	CC(=O)c1ccc(cc1)n2ccnc2
Canonical SMILES	OpenEye OEToolkits	3.1.0.0	CC(=O)c1ccc(cc1)n2ccnc2
InChI	InChI	1.06	InChI=1S/C11H10N2O/c1-9(14)10-2-4-11(5-3-10)13-7-6-12-8-13/h2-8H,1H3
InChIKey	InChI	1.06	GAIQQJIMVVUTQN-UHFFFAOYSA-N

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.