7-fluoranyl-3-methyl-6-(4-methylpiperazin-1-yl)-4-oxidanidyl-N-(1-oxidanylbutan-2-yl)-1-oxidanylidene-quinoxalin-1-ium-2-carboxamide

Systemtic Name: 7-fluoranyl-3-methyl-6-(4-methylpiperazin-1-yl)-4-oxidanidyl-N-(1-oxidanylbutan-2-yl)-1-oxidanylidene-quinoxalin-1-ium-2-carboxamide Openeye Name: 7-fluoro-N-[1-(hydroxymethyl)propyl]-3-methyl-6-(4-methylpiperazin-1-yl)-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxamide CAS Name: 7-fluoro-N-(1-hydroxybutan-2-yl)-3-methyl-6-(4-methyl-1-piperazinyl)-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxamide IUPAC Name: 7-fluoro-N-(1-hydroxybutan-2-yl)-3-methyl-6-(4-methylpiperazin-1-yl)-4-oxido-1-oxoquinoxalin-1-ium-2-carboxamide Traditional Name: 7-fluoro-1-keto-3-methyl-N-(1-methylolpropyl)-6-(4-methylpiperazino)-4-oxido-quinoxalin-1-ium-2-carboxamide Formula: C19H26FN5O4 MolecularWeight: 407.439243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=O)C1=C(N(C2=CC(=C(C=C2[N+]1=O)F)N3CCN(CC3)C)[O-])C

Isomeric SMILES

CCC(CO)NC(=O)C1=C(N(C2=CC(=C(C=C2[N+]1=O)F)N3CCN(CC3)C)[O-])C

InChI

InChI=1S/C19H26FN5O4/c1-4-13(11-26)21-19(27)18-12(2)24(28)17-10-15(14(20)9-16(17)25(18)29)23-7-5-22(3)6-8-23/h9-10,13,26H,4-8,11H2,1-3H3,(H,21,27)