(phenylmethyl) (2S)-4-methyl-2-[(1-methylcyclohexyl)carbamoylamino]pentanoate

Systemtic Name: (phenylmethyl) (2S)-4-methyl-2-[(1-methylcyclohexyl)carbamoylamino]pentanoate Openeye Name: benzyl (2S)-4-methyl-2-[(1-methylcyclohexyl)carbamoylamino]pentanoate CAS Name: (2S)-4-methyl-2-[[[(1-methylcyclohexyl)amino]-oxomethyl]amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-4-methyl-2-[(1-methylcyclohexyl)carbamoylamino]pentanoate Traditional Name: (2S)-4-methyl-2-[(1-methylcyclohexyl)carbamoylamino]valeric acid benzyl ester Formula: C21H32N2O3 MolecularWeight: 360.49038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(=O)NC2(CCCCC2)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)NC2(CCCCC2)C

InChI

InChI=1S/C21H32N2O3/c1-16(2)14-18(19(24)26-15-17-10-6-4-7-11-17)22-20(25)23-21(3)12-8-5-9-13-21/h4,6-7,10-11,16,18H,5,8-9,12-15H2,1-3H3,(H2,22,23,25)/t18-/m0/s1