4-[1-(cyclohexylmethyl)-2-oxidanylidene-3H-benzimidazol-5-yl]benzoic acid

Systemtic Name: 4-[1-(cyclohexylmethyl)-2-oxidanylidene-3H-benzimidazol-5-yl]benzoic acid Openeye Name: 4-[1-(cyclohexylmethyl)-2-oxo-3H-benzimidazol-5-yl]benzoic acid CAS Name: 4-[1-(cyclohexylmethyl)-2-oxo-3H-benzimidazol-5-yl]benzoic acid IUPAC Name: 4-[1-(cyclohexylmethyl)-2-oxo-3H-benzimidazol-5-yl]benzoic acid Traditional Name: 4-[1-(cyclohexylmethyl)-2-keto-3H-benzimidazol-5-yl]benzoic acid Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=C(C=C(C=C3)C4=CC=C(C=C4)C(=O)O)NC2=O

Isomeric SMILES

C1CCC(CC1)CN2C3=C(C=C(C=C3)C4=CC=C(C=C4)C(=O)O)NC2=O

InChI

InChI=1S/C21H22N2O3/c24-20(25)16-8-6-15(7-9-16)17-10-11-19-18(12-17)22-21(26)23(19)13-14-4-2-1-3-5-14/h6-12,14H,1-5,13H2,(H,22,26)(H,24,25)