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

Systemtic Name: 3-(1-ethylindol-3-yl)-3-(3-fluorophenyl)-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-3-(1-ethylindol-3-yl)-3-(3-fluorophenyl)propan-1-one CAS Name: 3-(1-ethyl-3-indolyl)-3-(3-fluorophenyl)-1-[4-(phenylmethyl)-1-piperidinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-(1-ethylindol-3-yl)-3-(3-fluorophenyl)propan-1-one Traditional Name: 1-(4-benzylpiperidino)-3-(1-ethylindol-3-yl)-3-(3-fluorophenyl)propan-1-one Formula: C31H33FN2O MolecularWeight: 468.604923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC(=CC=C5)F

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC(=CC=C5)F

InChI

InChI=1S/C31H33FN2O/c1-2-33-22-29(27-13-6-7-14-30(27)33)28(25-11-8-12-26(32)20-25)21-31(35)34-17-15-24(16-18-34)19-23-9-4-3-5-10-23/h3-14,20,22,24,28H,2,15-19,21H2,1H3