4-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-3-nitro-1-phenyl-quinolin-2-one

Systemtic Name: 4-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-3-nitro-1-phenyl-quinolin-2-one Openeye Name: 4-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-3-nitro-1-phenyl-quinolin-2-one CAS Name: 4-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-3-nitro-1-phenyl-2-quinolinone IUPAC Name: 4-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-3-nitro-1-phenylquinolin-2-one Traditional Name: 4-[4-(3-fluoro-4-methoxy-benzyl)piperazino]-3-nitro-1-phenyl-carbostyril Formula: C27H25FN4O4 MolecularWeight: 488.510203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=C(C(=O)N(C4=CC=CC=C43)C5=CC=CC=C5)[N+](=O)[O-])F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=C(C(=O)N(C4=CC=CC=C43)C5=CC=CC=C5)[N+](=O)[O-])F

InChI

InChI=1S/C27H25FN4O4/c1-36-24-12-11-19(17-22(24)28)18-29-13-15-30(16-14-29)25-21-9-5-6-10-23(21)31(20-7-3-2-4-8-20)27(33)26(25)32(34)35/h2-12,17H,13-16,18H2,1H3