2-[(2-ethylphenyl)amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 2-[(2-ethylphenyl)amino]benzene-1,3-dicarboxylic acid Openeye Name: 2-(2-ethylanilino)benzene-1,3-dicarboxylic acid CAS Name: 2-(2-ethylanilino)benzene-1,3-dicarboxylic acid IUPAC Name: 2-(2-ethylanilino)benzene-1,3-dicarboxylic acid Traditional Name: 2-(2-ethylanilino)isophthalic acid Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C=CC=C2C(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C=CC=C2C(=O)O)C(=O)O

InChI

InChI=1S/C16H15NO4/c1-2-10-6-3-4-9-13(10)17-14-11(15(18)19)7-5-8-12(14)16(20)21/h3-9,17H,2H2,1H3,(H,18,19)(H,20,21)