methyl (2S)-2-[(S)-acetamido-(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-butanoate

Systemtic Name: methyl (2S)-2-[(S)-acetamido-(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-butanoate Openeye Name: methyl (2S)-2-[(S)-acetamido-(3,4-dimethoxyphenyl)methyl]-3-oxo-butanoate CAS Name: (2S)-2-[(S)-acetamido-(3,4-dimethoxyphenyl)methyl]-3-oxobutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(S)-acetamido-(3,4-dimethoxyphenyl)methyl]-3-oxobutanoate Traditional Name: (2S)-2-[(S)-acetamido-(3,4-dimethoxyphenyl)methyl]-3-keto-butyric acid methyl ester Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO6/c1-9(18)14(16(20)23-5)15(17-10(2)19)11-6-7-12(21-3)13(8-11)22-4/h6-8,14-15H,1-5H3,(H,17,19)/t14-,15-/m1/s1