(phenylmethyl) N-[(2S)-1-[(4-acetamidophenyl)methylamino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(4-acetamidophenyl)methylamino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-[(4-acetamidophenyl)methylamino]-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[(4-acetamidophenyl)methylamino]-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(4-acetamidophenyl)methylamino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-[(4-acetamidobenzyl)amino]-2-keto-1-methyl-ethyl]carbamic acid benzyl ester Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)NC(=O)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)NC(=O)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H23N3O4/c1-14(22-20(26)27-13-17-6-4-3-5-7-17)19(25)21-12-16-8-10-18(11-9-16)23-15(2)24/h3-11,14H,12-13H2,1-2H3,(H,21,25)(H,22,26)(H,23,24)/t14-/m0/s1