4-ethanoyl-6-[[3-methyl-4-(methylamino)-2-oxidanyl-phenyl]carbamoyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4-ethanoyl-6-[[3-methyl-4-(methylamino)-2-oxidanyl-phenyl]carbamoyl]benzene-1,3-dicarboxylic acid Openeye Name: 4-acetyl-6-[[2-hydroxy-3-methyl-4-(methylamino)phenyl]carbamoyl]benzene-1,3-dicarboxylic acid CAS Name: 4-acetyl-6-[[2-hydroxy-3-methyl-4-(methylamino)anilino]-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-acetyl-6-[[2-hydroxy-3-methyl-4-(methylamino)phenyl]carbamoyl]benzene-1,3-dicarboxylic acid Traditional Name: 4-acetyl-6-[[2-hydroxy-3-methyl-4-(methylamino)phenyl]carbamoyl]isophthalic acid Formula: C19H18N2O7 MolecularWeight: 386.35542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)NC(=O)C2=C(C=C(C(=C2)C(=O)C)C(=O)O)C(=O)O)NC

Isomeric SMILES

CC1=C(C=CC(=C1O)NC(=O)C2=C(C=C(C(=C2)C(=O)C)C(=O)O)C(=O)O)NC

InChI

InChI=1S/C19H18N2O7/c1-8-14(20-3)4-5-15(16(8)23)21-17(24)11-6-10(9(2)22)12(18(25)26)7-13(11)19(27)28/h4-7,20,23H,1-3H3,(H,21,24)(H,25,26)(H,27,28)