3-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-6-fluoranyl-1-methyl-quinolin-4-one

Systemtic Name: 3-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-6-fluoranyl-1-methyl-quinolin-4-one Openeye Name: 3-(4-benzhydrylpiperazine-1-carbonyl)-6-fluoro-1-methyl-quinolin-4-one CAS Name: 3-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-6-fluoro-1-methyl-4-quinolinone IUPAC Name: 3-(4-benzhydrylpiperazine-1-carbonyl)-6-fluoro-1-methylquinolin-4-one Traditional Name: 3-(4-benzhydrylpiperazine-1-carbonyl)-6-fluoro-1-methyl-4-quinolone Formula: C28H26FN3O2 MolecularWeight: 455.523343

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=CC(=C2)F)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H26FN3O2/c1-30-19-24(27(33)23-18-22(29)12-13-25(23)30)28(34)32-16-14-31(15-17-32)26(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-13,18-19,26H,14-17H2,1H3