2-azanyl-4-fluoranyl-4-[4-(3-methylphenyl)-4-(piperidin-1-ylmethyl)piperidin-1-yl]-1-phenyl-butan-1-one

Systemtic Name: 2-azanyl-4-fluoranyl-4-[4-(3-methylphenyl)-4-(piperidin-1-ylmethyl)piperidin-1-yl]-1-phenyl-butan-1-one Openeye Name: 2-amino-4-fluoro-4-[4-(m-tolyl)-4-(1-piperidylmethyl)-1-piperidyl]-1-phenyl-butan-1-one CAS Name: 2-amino-4-fluoro-4-[4-(3-methylphenyl)-4-(1-piperidinylmethyl)-1-piperidinyl]-1-phenyl-1-butanone IUPAC Name: 2-amino-4-fluoro-4-[4-(3-methylphenyl)-4-(piperidin-1-ylmethyl)piperidin-1-yl]-1-phenylbutan-1-one Traditional Name: 2-amino-4-fluoro-4-[4-(m-tolyl)-4-(piperidinomethyl)piperidino]-1-phenyl-butan-1-one Formula: C28H38FN3O MolecularWeight: 451.619223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2(CCN(CC2)C(CC(C(=O)C3=CC=CC=C3)N)F)CN4CCCCC4

Isomeric SMILES

CC1=CC=CC(=C1)C2(CCN(CC2)C(CC(C(=O)C3=CC=CC=C3)N)F)CN4CCCCC4

InChI

InChI=1S/C28H38FN3O/c1-22-9-8-12-24(19-22)28(21-31-15-6-3-7-16-31)13-17-32(18-14-28)26(29)20-25(30)27(33)23-10-4-2-5-11-23/h2,4-5,8-12,19,25-26H,3,6-7,13-18,20-21,30H2,1H3