6-methoxy-5-[[(4-sulfamoylphenyl)methylamino]methyl]naphthalene-2-carboxylic acid

Systemtic Name: 6-methoxy-5-[[(4-sulfamoylphenyl)methylamino]methyl]naphthalene-2-carboxylic acid Openeye Name: 6-methoxy-5-[[(4-sulfamoylphenyl)methylamino]methyl]naphthalene-2-carboxylic acid CAS Name: 6-methoxy-5-[[(4-sulfamoylphenyl)methylamino]methyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-methoxy-5-[[(4-sulfamoylphenyl)methylamino]methyl]naphthalene-2-carboxylic acid Traditional Name: 6-methoxy-5-[[(4-sulfamoylbenzyl)amino]methyl]-2-naphthoic acid Formula: C20H20N2O5S MolecularWeight: 400.4482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C=C(C=C2)C(=O)O)CNCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

COC1=C(C2=C(C=C1)C=C(C=C2)C(=O)O)CNCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H20N2O5S/c1-27-19-9-5-14-10-15(20(23)24)4-8-17(14)18(19)12-22-11-13-2-6-16(7-3-13)28(21,25)26/h2-10,22H,11-12H2,1H3,(H,23,24)(H2,21,25,26)