methyl (2S)-3-methyl-2-[[3-[2-(methylamino)phenyl]-3-oxidanylidene-propanoyl]amino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[[3-[2-(methylamino)phenyl]-3-oxidanylidene-propanoyl]amino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[[3-[2-(methylamino)phenyl]-3-oxo-propanoyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[3-[2-(methylamino)phenyl]-1,3-dioxopropyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[3-[2-(methylamino)phenyl]-3-oxopropanoyl]amino]butanoate Traditional Name: (2S)-2-[[3-keto-3-[2-(methylamino)phenyl]propanoyl]amino]-3-methyl-butyric acid methyl ester Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)CC(=O)C1=CC=CC=C1NC

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)CC(=O)C1=CC=CC=C1NC

InChI

InChI=1S/C16H22N2O4/c1-10(2)15(16(21)22-4)18-14(20)9-13(19)11-7-5-6-8-12(11)17-3/h5-8,10,15,17H,9H2,1-4H3,(H,18,20)/t15-/m0/s1