[2-(4-methylphenyl)-2-oxidanylidene-ethyl] (2S)-4-methyl-2-[(4-methylcyclohexyl)carbonylamino]pentanoate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] (2S)-4-methyl-2-[(4-methylcyclohexyl)carbonylamino]pentanoate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] (2S)-4-methyl-2-[(4-methylcyclohexanecarbonyl)amino]pentanoate CAS Name: (2S)-4-methyl-2-[[(4-methylcyclohexyl)-oxomethyl]amino]pentanoic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] (2S)-4-methyl-2-[(4-methylcyclohexanecarbonyl)amino]pentanoate Traditional Name: (2S)-4-methyl-2-[(4-methylcyclohexanecarbonyl)amino]valeric acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C23H33NO4 MolecularWeight: 387.51242

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)NC(CC(C)C)C(=O)OCC(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1CCC(CC1)C(=O)N[C@@H](CC(C)C)C(=O)OCC(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C23H33NO4/c1-15(2)13-20(24-22(26)19-11-7-17(4)8-12-19)23(27)28-14-21(25)18-9-5-16(3)6-10-18/h5-6,9-10,15,17,19-20H,7-8,11-14H2,1-4H3,(H,24,26)/t17?,19?,20-/m0/s1