2-azanyl-3-(1,2,3,4-tetrahydroquinoxalin-6-ylcarbonylcarbamoyl)benzoic acid

Systemtic Name: 2-azanyl-3-(1,2,3,4-tetrahydroquinoxalin-6-ylcarbonylcarbamoyl)benzoic acid Openeye Name: 2-amino-3-(1,2,3,4-tetrahydroquinoxaline-6-carbonylcarbamoyl)benzoic acid CAS Name: 2-amino-3-[oxo-[[oxo(1,2,3,4-tetrahydroquinoxalin-6-yl)methyl]amino]methyl]benzoic acid IUPAC Name: 2-amino-3-(1,2,3,4-tetrahydroquinoxaline-6-carbonylcarbamoyl)benzoic acid Traditional Name: 2-amino-3-(1,2,3,4-tetrahydroquinoxaline-6-carbonylcarbamoyl)benzoic acid Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=C(N1)C=CC(=C2)C(=O)NC(=O)C3=C(C(=CC=C3)C(=O)O)N

Isomeric SMILES

C1CNC2=C(N1)C=CC(=C2)C(=O)NC(=O)C3=C(C(=CC=C3)C(=O)O)N

InChI

InChI=1S/C17H16N4O4/c18-14-10(2-1-3-11(14)17(24)25)16(23)21-15(22)9-4-5-12-13(8-9)20-7-6-19-12/h1-5,8,19-20H,6-7,18H2,(H,24,25)(H,21,22,23)