[(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 2-[(3,4-dimethylphenyl)carbonylamino]ethanoate

Systemtic Name: [(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 2-[(3,4-dimethylphenyl)carbonylamino]ethanoate Openeye Name: [(1R)-2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 2-[(3,4-dimethylbenzoyl)amino]acetate CAS Name: 2-[[(3,4-dimethylphenyl)-oxomethyl]amino]acetic acid [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] 2-[(3,4-dimethylbenzoyl)amino]acetate Traditional Name: 2-[(3,4-dimethylbenzoyl)amino]acetic acid [(1R)-2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)OC(C)C(=O)NC2CCCCCC2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)O[C@H](C)C(=O)NC2CCCCCC2)C

InChI

InChI=1S/C21H30N2O4/c1-14-10-11-17(12-15(14)2)21(26)22-13-19(24)27-16(3)20(25)23-18-8-6-4-5-7-9-18/h10-12,16,18H,4-9,13H2,1-3H3,(H,22,26)(H,23,25)/t16-/m1/s1