5-[ethanoyl-(4-methylphenyl)amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[ethanoyl-(4-methylphenyl)amino]benzene-1,3-dicarboxylic acid Openeye Name: 5-(N-acetyl-4-methyl-anilino)benzene-1,3-dicarboxylic acid CAS Name: 5-(N-acetyl-4-methylanilino)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(N-acetyl-4-methylanilino)benzene-1,3-dicarboxylic acid Traditional Name: 5-(N-acetyl-4-methyl-anilino)isophthalic acid Formula: C17H15NO5 MolecularWeight: 313.3047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=CC(=CC(=C2)C(=O)O)C(=O)O)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=CC(=CC(=C2)C(=O)O)C(=O)O)C(=O)C

InChI

InChI=1S/C17H15NO5/c1-10-3-5-14(6-4-10)18(11(2)19)15-8-12(16(20)21)7-13(9-15)17(22)23/h3-9H,1-2H3,(H,20,21)(H,22,23)