5-[(3-methyl-4-oxidanyl-naphthalen-1-yl)sulfonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(3-methyl-4-oxidanyl-naphthalen-1-yl)sulfonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(4-hydroxy-3-methyl-1-naphthyl)sulfonylamino]benzene-1,3-dicarboxylic acid CAS Name: 5-[(4-hydroxy-3-methyl-1-naphthalenyl)sulfonylamino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(4-hydroxy-3-methylnaphthalen-1-yl)sulfonylamino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(4-hydroxy-3-methyl-1-naphthyl)sulfonylamino]isophthalic acid Formula: C19H15NO7S MolecularWeight: 401.3899

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C(=C1)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2C(=C1)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O)O

InChI

InChI=1S/C19H15NO7S/c1-10-6-16(14-4-2-3-5-15(14)17(10)21)28(26,27)20-13-8-11(18(22)23)7-12(9-13)19(24)25/h2-9,20-21H,1H3,(H,22,23)(H,24,25)