1-[3-(3-fluorophenyl)-4-(piperidin-1-ylmethyl)pyrrolidin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[3-(3-fluorophenyl)-4-(piperidin-1-ylmethyl)pyrrolidin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[3-(3-fluorophenyl)-4-(1-piperidylmethyl)pyrrolidin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[3-(3-fluorophenyl)-4-(1-piperidinylmethyl)-1-pyrrolidinyl]-3-methyl-1-butanone IUPAC Name: 1-[3-(3-fluorophenyl)-4-(piperidin-1-ylmethyl)pyrrolidin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[3-(3-fluorophenyl)-4-(piperidinomethyl)pyrrolidino]-3-methyl-butan-1-one Formula: C21H31FN2O MolecularWeight: 346.482043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CC(C(C1)C2=CC(=CC=C2)F)CN3CCCCC3

Isomeric SMILES

CC(C)CC(=O)N1CC(C(C1)C2=CC(=CC=C2)F)CN3CCCCC3

InChI

InChI=1S/C21H31FN2O/c1-16(2)11-21(25)24-14-18(13-23-9-4-3-5-10-23)20(15-24)17-7-6-8-19(22)12-17/h6-8,12,16,18,20H,3-5,9-11,13-15H2,1-2H3