4-[4-[(5-cyano-1H-imidazol-2-yl)carbonylamino]-3-(4,4-dimethylcyclohexen-1-yl)phenyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[4-[(5-cyano-1H-imidazol-2-yl)carbonylamino]-3-(4,4-dimethylcyclohexen-1-yl)phenyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[4-[(5-cyano-1H-imidazole-2-carbonyl)amino]-3-(4,4-dimethylcyclohexen-1-yl)phenyl]cyclohexanecarboxylic acid CAS Name: 4-[4-[[(5-cyano-1H-imidazol-2-yl)-oxomethyl]amino]-3-(4,4-dimethyl-1-cyclohexenyl)phenyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[4-[(5-cyano-1H-imidazole-2-carbonyl)amino]-3-(4,4-dimethylcyclohexen-1-yl)phenyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[4-[(5-cyano-1H-imidazole-2-carbonyl)amino]-3-(4,4-dimethylcyclohexen-1-yl)phenyl]cyclohexanecarboxylic acid Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=CC1)C2=C(C=CC(=C2)C3CCC(CC3)C(=O)O)NC(=O)C4=NC=C(N4)C#N)C

Isomeric SMILES

CC1(CCC(=CC1)C2=C(C=CC(=C2)C3CCC(CC3)C(=O)O)NC(=O)C4=NC=C(N4)C#N)C

InChI

InChI=1S/C26H30N4O3/c1-26(2)11-9-17(10-12-26)21-13-19(16-3-5-18(6-4-16)25(32)33)7-8-22(21)30-24(31)23-28-15-20(14-27)29-23/h7-9,13,15-16,18H,3-6,10-12H2,1-2H3,(H,28,29)(H,30,31)(H,32,33)