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

Systemtic Name: 6-fluoranyl-N-(2-hydroxyethyl)-3-methyl-7-(4-methylpiperazin-1-yl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxamide Openeye Name: 6-fluoro-N-(2-hydroxyethyl)-3-methyl-7-(4-methylpiperazin-1-yl)-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxamide CAS Name: 6-fluoro-N-(2-hydroxyethyl)-3-methyl-7-(4-methyl-1-piperazinyl)-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxamide IUPAC Name: 6-fluoro-N-(2-hydroxyethyl)-3-methyl-7-(4-methylpiperazin-1-yl)-4-oxido-1-oxoquinoxalin-1-ium-2-carboxamide Traditional Name: 6-fluoro-N-(2-hydroxyethyl)-1-keto-3-methyl-7-(4-methylpiperazino)-4-oxido-quinoxalin-1-ium-2-carboxamide Formula: C17H22FN5O4 MolecularWeight: 379.386083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=O)C2=CC(=C(C=C2N1[O-])F)N3CCN(CC3)C)C(=O)NCCO

Isomeric SMILES

CC1=C([N+](=O)C2=CC(=C(C=C2N1[O-])F)N3CCN(CC3)C)C(=O)NCCO

InChI

InChI=1S/C17H22FN5O4/c1-11-16(17(25)19-3-8-24)23(27)15-10-13(12(18)9-14(15)22(11)26)21-6-4-20(2)5-7-21/h9-10,24H,3-8H2,1-2H3,(H,19,25)