(2R,3S)-2,3-diacetyloxy-4-[(4-methylphenyl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: (2R,3S)-2,3-diacetyloxy-4-[(4-methylphenyl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: (2R,3S)-2,3-diacetoxy-4-oxo-4-(p-tolylmethylamino)butanoic acid CAS Name: (2R,3S)-2,3-diacetyloxy-4-[(4-methylphenyl)methylamino]-4-oxobutanoic acid IUPAC Name: (2R,3S)-2,3-diacetyloxy-4-[(4-methylphenyl)methylamino]-4-oxobutanoic acid Traditional Name: (2R,3S)-2,3-diacetoxy-4-keto-4-[(4-methylbenzyl)amino]butyric acid Formula: C16H19NO7 MolecularWeight: 337.32456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(C(C(=O)O)OC(=O)C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@H]([C@H](C(=O)O)OC(=O)C)OC(=O)C

InChI

InChI=1S/C16H19NO7/c1-9-4-6-12(7-5-9)8-17-15(20)13(23-10(2)18)14(16(21)22)24-11(3)19/h4-7,13-14H,8H2,1-3H3,(H,17,20)(H,21,22)/t13-,14+/m0/s1