4-[(2,3-dicarboxyphenyl)carbamoyl]benzene-1,2,3-tricarboxylic acid

Systemtic Name: 4-[(2,3-dicarboxyphenyl)carbamoyl]benzene-1,2,3-tricarboxylic acid Openeye Name: 4-[(2,3-dicarboxyphenyl)carbamoyl]benzene-1,2,3-tricarboxylic acid CAS Name: 4-[(2,3-dicarboxyanilino)-oxomethyl]benzene-1,2,3-tricarboxylic acid IUPAC Name: 4-[(2,3-dicarboxyphenyl)carbamoyl]benzene-1,2,3-tricarboxylic acid Traditional Name: 4-[(2,3-dicarboxyphenyl)carbamoyl]hemimellitic acid Formula: C18H11NO11 MolecularWeight: 417.28004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)NC(=O)C2=C(C(=C(C=C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)NC(=O)C2=C(C(=C(C=C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C18H11NO11/c20-13(19-9-3-1-2-7(14(21)22)10(9)16(25)26)6-4-5-8(15(23)24)12(18(29)30)11(6)17(27)28/h1-5H,(H,19,20)(H,21,22)(H,23,24)(H,25,26)(H,27,28)(H,29,30)