3-(3-fluorophenyl)-3-(1-methylindol-3-yl)-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(3-fluorophenyl)-3-(1-methylindol-3-yl)-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-3-(3-fluorophenyl)-3-(1-methylindol-3-yl)propan-1-one CAS Name: 3-(3-fluorophenyl)-3-(1-methyl-3-indolyl)-1-[4-(phenylmethyl)-1-piperidinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-(3-fluorophenyl)-3-(1-methylindol-3-yl)propan-1-one Traditional Name: 1-(4-benzylpiperidino)-3-(3-fluorophenyl)-3-(1-methylindol-3-yl)propan-1-one Formula: C30H31FN2O MolecularWeight: 454.578343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC(=CC=C5)F

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC(=CC=C5)F

InChI

InChI=1S/C30H31FN2O/c1-32-21-28(26-12-5-6-13-29(26)32)27(24-10-7-11-25(31)19-24)20-30(34)33-16-14-23(15-17-33)18-22-8-3-2-4-9-22/h2-13,19,21,23,27H,14-18,20H2,1H3