(phenylmethyl) N-[(2S)-1-[(3,4-dimethylphenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(3,4-dimethylphenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(3,4-dimethylphenyl)carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-1-(3,4-dimethylanilino)-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(3,4-dimethylanilino)-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(3,4-dimethylphenyl)carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](CC(C)C)NC(=O)OCC2=CC=CC=C2)C

InChI

InChI=1S/C22H28N2O3/c1-15(2)12-20(21(25)23-19-11-10-16(3)17(4)13-19)24-22(26)27-14-18-8-6-5-7-9-18/h5-11,13,15,20H,12,14H2,1-4H3,(H,23,25)(H,24,26)/t20-/m0/s1