3-(3,4-dimethoxyphenyl)-3-(phenylsulfonylamino)propanoic acid

Systemtic Name: 3-(3,4-dimethoxyphenyl)-3-(phenylsulfonylamino)propanoic acid Openeye Name: 3-(benzenesulfonamido)-3-(3,4-dimethoxyphenyl)propanoic acid CAS Name: 3-(benzenesulfonamido)-3-(3,4-dimethoxyphenyl)propanoic acid IUPAC Name: 3-(benzenesulfonamido)-3-(3,4-dimethoxyphenyl)propanoic acid Traditional Name: 3-(benzenesulfonamido)-3-(3,4-dimethoxyphenyl)propionic acid Formula: C17H19NO6S MolecularWeight: 365.40086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C17H19NO6S/c1-23-15-9-8-12(10-16(15)24-2)14(11-17(19)20)18-25(21,22)13-6-4-3-5-7-13/h3-10,14,18H,11H2,1-2H3,(H,19,20)