4-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]benzoate

Systemtic Name: 4-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]benzoate Openeye Name: 4-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]benzoate CAS Name: 4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoate IUPAC Name: 4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoate Traditional Name: 4-[(3,4-dimethoxyphenyl)sulfonyl-methyl-amino]benzoate Formula: C16H16NO6S- MolecularWeight: 350.36634

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C(=O)[O-])S(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CN(C1=CC=C(C=C1)C(=O)[O-])S(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H17NO6S/c1-17(12-6-4-11(5-7-12)16(18)19)24(20,21)13-8-9-14(22-2)15(10-13)23-3/h4-10H,1-3H3,(H,18,19)/p-1