2-[[4-(8-oxidanylidene-4H-quinoxalin-2-yl)piperazin-1-yl]carbonylamino]benzoic acid

Systemtic Name: 2-[[4-(8-oxidanylidene-4H-quinoxalin-2-yl)piperazin-1-yl]carbonylamino]benzoic acid Openeye Name: 2-[[4-(8-oxo-4H-quinoxalin-2-yl)piperazine-1-carbonyl]amino]benzoic acid CAS Name: 2-[[oxo-[4-(8-oxo-4H-quinoxalin-2-yl)-1-piperazinyl]methyl]amino]benzoic acid IUPAC Name: 2-[[4-(8-oxo-4H-quinoxalin-2-yl)piperazine-1-carbonyl]amino]benzoic acid Traditional Name: 2-[[4-(8-keto-4H-quinoxalin-2-yl)piperazine-1-carbonyl]amino]benzoic acid Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CNC3=CC=CC(=O)C3=N2)C(=O)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CNC3=CC=CC(=O)C3=N2)C(=O)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C20H19N5O4/c26-16-7-3-6-15-18(16)23-17(12-21-15)24-8-10-25(11-9-24)20(29)22-14-5-2-1-4-13(14)19(27)28/h1-7,12,21H,8-11H2,(H,22,29)(H,27,28)