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

Systemtic Name: 2-[4-[[5-cyclohexyl-3-(2-cyclohexylethyl)-2-oxidanylidene-imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[5-cyclohexyl-3-(2-cyclohexylethyl)-2-oxo-imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[5-cyclohexyl-3-(2-cyclohexylethyl)-2-oxo-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[5-cyclohexyl-3-(2-cyclohexylethyl)-2-oxoimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[5-cyclohexyl-3-(2-cyclohexylethyl)-2-keto-4-imidazolin-1-yl]methyl]phenyl]benzoic acid Formula: C31H38N2O3 MolecularWeight: 486.64502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCN2C=C(N(C2=O)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5CCCCC5

Isomeric SMILES

C1CCC(CC1)CCN2C=C(N(C2=O)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O)C5CCCCC5

InChI

InChI=1S/C31H38N2O3/c34-30(35)28-14-8-7-13-27(28)25-17-15-24(16-18-25)21-33-29(26-11-5-2-6-12-26)22-32(31(33)36)20-19-23-9-3-1-4-10-23/h7-8,13-18,22-23,26H,1-6,9-12,19-21H2,(H,34,35)