N-[3-[(3-aminophenyl)carbonylamino]phenyl]-3-azanyl-benzamide; benzene-1,3-dicarboxylic acid

Systemtic Name: N-[3-[(3-aminophenyl)carbonylamino]phenyl]-3-azanyl-benzamide; benzene-1,3-dicarboxylic acid Openeye Name: 3-amino-N-[3-[(3-aminobenzoyl)amino]phenyl]benzamide; isophthalic acid CAS Name: 3-amino-N-[3-[[(3-aminophenyl)-oxomethyl]amino]phenyl]benzamide; benzene-1,3-dicarboxylic acid IUPAC Name: 3-amino-N-[3-[(3-aminobenzoyl)amino]phenyl]benzamide; benzene-1,3-dicarboxylic acid Traditional Name: 3-amino-N-[3-[(3-aminobenzoyl)amino]phenyl]benzamide; isophthalic acid Formula: C28H24N4O6 MolecularWeight: 512.51336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC(=C1)N)C(=O)NC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC(=C1)N)C(=O)NC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)N

InChI

InChI=1S/C20H18N4O2.C8H6O4/c21-15-6-1-4-13(10-15)19(25)23-17-8-3-9-18(12-17)24-20(26)14-5-2-7-16(22)11-14;9-7(10)5-2-1-3-6(4-5)8(11)12/h1-12H,21-22H2,(H,23,25)(H,24,26);1-4H,(H,9,10)(H,11,12)