2-[[4-[(3-chloranyl-4,5-dimethoxy-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(3-chloranyl-4,5-dimethoxy-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[(3-chloro-4,5-dimethoxy-benzoyl)amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[(3-chloro-4,5-dimethoxyphenyl)-oxomethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[(3-chloro-4,5-dimethoxybenzoyl)amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[(3-chloro-4,5-dimethoxy-benzoyl)amino]phenyl]sulfonylamino]acetic acid Formula: C17H17ClN2O7S MolecularWeight: 428.84408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O)Cl)OC

InChI

InChI=1S/C17H17ClN2O7S/c1-26-14-8-10(7-13(18)16(14)27-2)17(23)20-11-3-5-12(6-4-11)28(24,25)19-9-15(21)22/h3-8,19H,9H2,1-2H3,(H,20,23)(H,21,22)