7-[4-(4-fluorophenyl)piperazin-1-yl]-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid

Systemtic Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]-6-nitro-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid Openeye Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid CAS Name: 7-[4-(4-fluorophenyl)-1-piperazinyl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid IUPAC Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]-6-nitro-3-oxo-4H-quinoxaline-2-carboxylic acid Traditional Name: 7-[4-(4-fluorophenyl)piperazino]-3-keto-6-nitro-4H-quinoxaline-2-carboxylic acid Formula: C19H16FN5O5 MolecularWeight: 413.359243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C19H16FN5O5/c20-11-1-3-12(4-2-11)23-5-7-24(8-6-23)15-9-13-14(10-16(15)25(29)30)22-18(26)17(21-13)19(27)28/h1-4,9-10H,5-8H2,(H,22,26)(H,27,28)