4-[[5-[(4-carboxyphenyl)sulfamoyl]-6-methoxy-naphthalen-2-yl]sulfonylamino]benzoic acid

Systemtic Name: 4-[[5-[(4-carboxyphenyl)sulfamoyl]-6-methoxy-naphthalen-2-yl]sulfonylamino]benzoic acid Openeye Name: 4-[[5-[(4-carboxyphenyl)sulfamoyl]-6-methoxy-2-naphthyl]sulfonylamino]benzoic acid CAS Name: 4-[[5-[(4-carboxyphenyl)sulfamoyl]-6-methoxy-2-naphthalenyl]sulfonylamino]benzoic acid IUPAC Name: 4-[[5-[(4-carboxyphenyl)sulfamoyl]-6-methoxynaphthalen-2-yl]sulfonylamino]benzoic acid Traditional Name: 4-[[5-[(4-carboxyphenyl)sulfamoyl]-6-methoxy-2-naphthyl]sulfonylamino]benzoic acid Formula: C25H20N2O9S2 MolecularWeight: 556.5643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)O)S(=O)(=O)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=C(C2=C(C=C1)C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)O)S(=O)(=O)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H20N2O9S2/c1-36-22-13-6-17-14-20(37(32,33)26-18-7-2-15(3-8-18)24(28)29)11-12-21(17)23(22)38(34,35)27-19-9-4-16(5-10-19)25(30)31/h2-14,26-27H,1H3,(H,28,29)(H,30,31)