4-methoxy-3-(2-oxidanylidene-4-phenyl-pyrrolidin-1-yl)sulfonyl-benzoic acid

Systemtic Name: 4-methoxy-3-(2-oxidanylidene-4-phenyl-pyrrolidin-1-yl)sulfonyl-benzoic acid Openeye Name: 4-methoxy-3-(2-oxo-4-phenyl-pyrrolidin-1-yl)sulfonyl-benzoic acid CAS Name: 4-methoxy-3-[(2-oxo-4-phenyl-1-pyrrolidinyl)sulfonyl]benzoic acid IUPAC Name: 4-methoxy-3-(2-oxo-4-phenylpyrrolidin-1-yl)sulfonylbenzoic acid Traditional Name: 3-(2-keto-4-phenyl-pyrrolidino)sulfonyl-4-methoxy-benzoic acid Formula: C18H17NO6S MolecularWeight: 375.39568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CC(CC2=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CC(CC2=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17NO6S/c1-25-15-8-7-13(18(21)22)9-16(15)26(23,24)19-11-14(10-17(19)20)12-5-3-2-4-6-12/h2-9,14H,10-11H2,1H3,(H,21,22)