1-[3-(dimethylamino)propyl]-4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-nitro-quinolin-2-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H28FN5O4/c1-27(2)12-5-13-30-21-7-4-3-6-20(21)22(23(25(30)33)31(34)35)28-14-16-29(17-15-28)24(32)18-8-10-19(26)11-9-18/h3-4,6-11H,5,12-17H2,1-2H3