4-[(2R)-2-(3,4-dimethoxyphenyl)-3-ethanoyl-4-oxidanidyl-5-oxidanylidene-2H-pyrrol-1-yl]butanoate

Systemtic Name: 4-[(2R)-2-(3,4-dimethoxyphenyl)-3-ethanoyl-4-oxidanidyl-5-oxidanylidene-2H-pyrrol-1-yl]butanoate Openeye Name: 4-[(2R)-3-acetyl-2-(3,4-dimethoxyphenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]butanoate CAS Name: 4-[(2R)-3-acetyl-2-(3,4-dimethoxyphenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]butanoate IUPAC Name: 4-[(2R)-3-acetyl-2-(3,4-dimethoxyphenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]butanoate Traditional Name: 4-[(2R)-3-acetyl-2-(3,4-dimethoxyphenyl)-5-keto-4-oxido-3-pyrrolin-1-yl]butyrate Formula: C18H19NO7-2 MolecularWeight: 361.34596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC(=C(C=C2)OC)OC)CCCC(=O)[O-])[O-]

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@@H]1C2=CC(=C(C=C2)OC)OC)CCCC(=O)[O-])[O-]

InChI

InChI=1S/C18H21NO7/c1-10(20)15-16(11-6-7-12(25-2)13(9-11)26-3)19(18(24)17(15)23)8-4-5-14(21)22/h6-7,9,16,23H,4-5,8H2,1-3H3,(H,21,22)/p-2/t16-/m1/s1