methyl (2S)-2-[(3-acetamidophenyl)carbamoylamino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[(3-acetamidophenyl)carbamoylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[(3-acetamidophenyl)carbamoylamino]-3-methyl-butanoate CAS Name: (2S)-2-[[(3-acetamidoanilino)-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3-acetamidophenyl)carbamoylamino]-3-methylbutanoate Traditional Name: (2S)-2-[(3-acetamidophenyl)carbamoylamino]-3-methyl-butyric acid methyl ester Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)NC1=CC=CC(=C1)NC(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)NC1=CC=CC(=C1)NC(=O)C

InChI

InChI=1S/C15H21N3O4/c1-9(2)13(14(20)22-4)18-15(21)17-12-7-5-6-11(8-12)16-10(3)19/h5-9,13H,1-4H3,(H,16,19)(H2,17,18,21)/t13-/m0/s1