5-[(4-bromanyl-1-oxidanyl-naphthalen-2-yl)carbonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(4-bromanyl-1-oxidanyl-naphthalen-2-yl)carbonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(4-bromo-1-hydroxy-naphthalene-2-carbonyl)amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[(4-bromo-1-hydroxy-2-naphthalenyl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(4-bromo-1-hydroxynaphthalene-2-carbonyl)amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(4-bromo-1-hydroxy-2-naphthoyl)amino]isophthalic acid Formula: C19H12BrNO6 MolecularWeight: 430.20568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O)Br

InChI

InChI=1S/C19H12BrNO6/c20-15-8-14(16(22)13-4-2-1-3-12(13)15)17(23)21-11-6-9(18(24)25)5-10(7-11)19(26)27/h1-8,22H,(H,21,23)(H,24,25)(H,26,27)