4-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]-3-nitro-1-phenyl-quinolin-2-one

Systemtic Name: 4-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]-3-nitro-1-phenyl-quinolin-2-one Openeye Name: 4-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazin-1-yl]-3-nitro-1-phenyl-quinolin-2-one CAS Name: 4-[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazinyl]-3-nitro-1-phenyl-2-quinolinone IUPAC Name: 4-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]-3-nitro-1-phenylquinolin-2-one Traditional Name: 4-[4-(5-fluoro-2-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)F)CN2CCN(CC2)C3=C(C(=O)N(C4=CC=CC=C43)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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