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

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(3,4-dimethylphenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(3,4-dimethylphenyl)carbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-(3,4-dimethylanilino)-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(3,4-dimethylanilino)-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(3,4-dimethylphenyl)carbamoyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3/c1-14(2)19(20(24)22-18-11-10-15(3)16(4)12-18)23-21(25)26-13-17-8-6-5-7-9-17/h5-12,14,19H,13H2,1-4H3,(H,22,24)(H,23,25)/t19-/m0/s1