4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)-1-[4-(phenylmethyl)piperidin-1-yl]butan-1-one

Systemtic Name: 4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)-1-[4-(phenylmethyl)piperidin-1-yl]butan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butan-1-one CAS Name: 4-[5-methyl-2-(2-pyridinyl)-1H-indol-3-yl]-1-[4-(phenylmethyl)-1-piperidinyl]-1-butanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butan-1-one Traditional Name: 1-(4-benzylpiperidino)-4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butan-1-one Formula: C30H33N3O MolecularWeight: 451.60252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC=CC=N5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)N3CCC(CC3)CC4=CC=CC=C4)C5=CC=CC=N5

InChI

InChI=1S/C30H33N3O/c1-22-13-14-27-26(20-22)25(30(32-27)28-11-5-6-17-31-28)10-7-12-29(34)33-18-15-24(16-19-33)21-23-8-3-2-4-9-23/h2-6,8-9,11,13-14,17,20,24,32H,7,10,12,15-16,18-19,21H2,1H3