4-[2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethyl]benzoic acid CAS Name: 4-[2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethyl]benzoic acid IUPAC Name: 4-[2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethyl]benzoic acid Traditional Name: 4-[2-[(3,5-dicarbomethoxyphenyl)sulfonylamino]ethyl]benzoic acid Formula: C19H19NO8S MolecularWeight: 421.42106

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O)C(=O)OC

InChI

InChI=1S/C19H19NO8S/c1-27-18(23)14-9-15(19(24)28-2)11-16(10-14)29(25,26)20-8-7-12-3-5-13(6-4-12)17(21)22/h3-6,9-11,20H,7-8H2,1-2H3,(H,21,22)