1-[4-(phenylmethyl)piperidin-1-yl]-4-(2-pyridin-2-yl-1H-indol-3-yl)butan-1-one

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-4-(2-pyridin-2-yl-1H-indol-3-yl)butan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-4-[2-(2-pyridyl)-1H-indol-3-yl]butan-1-one CAS Name: 1-[4-(phenylmethyl)-1-piperidinyl]-4-[2-(2-pyridinyl)-1H-indol-3-yl]-1-butanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-4-(2-pyridin-2-yl-1H-indol-3-yl)butan-1-one Traditional Name: 1-(4-benzylpiperidino)-4-[2-(2-pyridyl)-1H-indol-3-yl]butan-1-one Formula: C29H31N3O MolecularWeight: 437.57594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CCCC3=C(NC4=CC=CC=C43)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CCCC3=C(NC4=CC=CC=C43)C5=CC=CC=N5

InChI

InChI=1S/C29H31N3O/c33-28(32-19-16-23(17-20-32)21-22-9-2-1-3-10-22)15-8-12-25-24-11-4-5-13-26(24)31-29(25)27-14-6-7-18-30-27/h1-7,9-11,13-14,18,23,31H,8,12,15-17,19-21H2