1-(2-dimethylaminoethyl)-4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-6-methyl-3-nitro-quinolin-2-one

Systemtic Name: 1-(2-dimethylaminoethyl)-4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-6-methyl-3-nitro-quinolin-2-one Openeye Name: 1-(2-dimethylaminoethyl)-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-methyl-3-nitro-quinolin-2-one CAS Name: 1-(2-dimethylaminoethyl)-4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-6-methyl-3-nitro-2-quinolinone IUPAC Name: 1-(2-dimethylaminoethyl)-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-methyl-3-nitroquinolin-2-one Traditional Name: 1-(2-dimethylaminoethyl)-4-[4-(4-fluorobenzoyl)piperazino]-6-methyl-3-nitro-carbostyril Formula: C25H28FN5O4 MolecularWeight: 481.519323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)F)[N+](=O)[O-])CCN(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)F)[N+](=O)[O-])CCN(C)C

InChI

InChI=1S/C25H28FN5O4/c1-17-4-9-21-20(16-17)22(23(31(34)35)25(33)30(21)15-10-27(2)3)28-11-13-29(14-12-28)24(32)18-5-7-19(26)8-6-18/h4-9,16H,10-15H2,1-3H3