1-tert-butyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-3-nitro-quinolin-4-one

Systemtic Name: 1-tert-butyl-6-fluoranyl-7-(4-methylpiperazin-1-yl)-3-nitro-quinolin-4-one Openeye Name: 1-tert-butyl-6-fluoro-7-(4-methylpiperazin-1-yl)-3-nitro-quinolin-4-one CAS Name: 1-tert-butyl-6-fluoro-7-(4-methyl-1-piperazinyl)-3-nitro-4-quinolinone IUPAC Name: 1-tert-butyl-6-fluoro-7-(4-methylpiperazin-1-yl)-3-nitroquinolin-4-one Traditional Name: 1-tert-butyl-6-fluoro-7-(4-methylpiperazino)-3-nitro-4-quinolone Formula: C18H23FN4O3 MolecularWeight: 362.398623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)[N+](=O)[O-]

InChI

InChI=1S/C18H23FN4O3/c1-18(2,3)22-11-16(23(25)26)17(24)12-9-13(19)15(10-14(12)22)21-7-5-20(4)6-8-21/h9-11H,5-8H2,1-4H3