3-(7-ethyl-1H-indol-3-yl)-4-phenyl-1-[4-(phenylmethyl)piperidin-1-yl]butan-1-one

Systemtic Name: 3-(7-ethyl-1H-indol-3-yl)-4-phenyl-1-[4-(phenylmethyl)piperidin-1-yl]butan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-3-(7-ethyl-1H-indol-3-yl)-4-phenyl-butan-1-one CAS Name: 3-(7-ethyl-1H-indol-3-yl)-4-phenyl-1-[4-(phenylmethyl)-1-piperidinyl]-1-butanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-(7-ethyl-1H-indol-3-yl)-4-phenylbutan-1-one Traditional Name: 1-(4-benzylpiperidino)-3-(7-ethyl-1H-indol-3-yl)-4-phenyl-butan-1-one Formula: C32H36N2O MolecularWeight: 464.64104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(CC3=CC=CC=C3)CC(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(CC3=CC=CC=C3)CC(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C32H36N2O/c1-2-27-14-9-15-29-30(23-33-32(27)29)28(21-25-12-7-4-8-13-25)22-31(35)34-18-16-26(17-19-34)20-24-10-5-3-6-11-24/h3-15,23,26,28,33H,2,16-22H2,1H3