[1-[(2-methylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-methylphenyl)carbonylbenzoate

Systemtic Name: [1-[(2-methylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-methylphenyl)carbonylbenzoate Openeye Name: [1-methyl-2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl] 2-(4-methylbenzoyl)benzoate CAS Name: 2-[(4-methylphenyl)-oxomethyl]benzoic acid [1-[(2-methylcyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-methylcyclohexyl)amino]-1-oxopropan-2-yl] 2-(4-methylbenzoyl)benzoate Traditional Name: 2-p-toluoylbenzoic acid [2-keto-1-methyl-2-[(2-methylcyclohexyl)amino]ethyl] ester Formula: C25H29NO4 MolecularWeight: 407.50206

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(C)OC(=O)C2=CC=CC=C2C(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1CCCCC1NC(=O)C(C)OC(=O)C2=CC=CC=C2C(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H29NO4/c1-16-12-14-19(15-13-16)23(27)20-9-5-6-10-21(20)25(29)30-18(3)24(28)26-22-11-7-4-8-17(22)2/h5-6,9-10,12-15,17-18,22H,4,7-8,11H2,1-3H3,(H,26,28)