(3S)-3-(3,4-dimethoxyphenyl)-3-(methylsulfonylamino)propanoate

Systemtic Name: (3S)-3-(3,4-dimethoxyphenyl)-3-(methylsulfonylamino)propanoate Openeye Name: (3S)-3-(3,4-dimethoxyphenyl)-3-(methanesulfonamido)propanoate CAS Name: (3S)-3-(3,4-dimethoxyphenyl)-3-(methanesulfonamido)propanoate IUPAC Name: (3S)-3-(3,4-dimethoxyphenyl)-3-(methanesulfonamido)propanoate Traditional Name: (3S)-3-(3,4-dimethoxyphenyl)-3-(methanesulfonamido)propionate Formula: C12H16NO6S- MolecularWeight: 302.32354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)[O-])NS(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H](CC(=O)[O-])NS(=O)(=O)C)OC

InChI

InChI=1S/C12H17NO6S/c1-18-10-5-4-8(6-11(10)19-2)9(7-12(14)15)13-20(3,16)17/h4-6,9,13H,7H2,1-3H3,(H,14,15)/p-1/t9-/m0/s1