2-[4-[[5-cyclohexyl-3-(cyclohexylmethyl)-2-oxidanylidene-imidazol-1-yl]methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[[5-cyclohexyl-3-(cyclohexylmethyl)-2-oxidanylidene-imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[5-cyclohexyl-3-(cyclohexylmethyl)-2-oxo-imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[5-cyclohexyl-3-(cyclohexylmethyl)-2-oxo-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[5-cyclohexyl-3-(cyclohexylmethyl)-2-oxoimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[5-cyclohexyl-3-(cyclohexylmethyl)-2-keto-4-imidazolin-1-yl]methyl]phenyl]benzoic acid Formula: C30H36N2O3 MolecularWeight: 472.61844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C=C(N(C2=O)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5CCCCC5

Isomeric SMILES

C1CCC(CC1)CN2C=C(N(C2=O)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5CCCCC5

InChI

InChI=1S/C30H36N2O3/c33-29(34)27-14-8-7-13-26(27)24-17-15-23(16-18-24)20-32-28(25-11-5-2-6-12-25)21-31(30(32)35)19-22-9-3-1-4-10-22/h7-8,13-18,21-22,25H,1-6,9-12,19-20H2,(H,33,34)