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

Systemtic Name: 4-phenyl-3-[1-(phenylmethyl)indol-3-yl]-1-[4-(phenylmethyl)piperidin-1-yl]butan-1-one Openeye Name: 3-(1-benzylindol-3-yl)-1-(4-benzyl-1-piperidyl)-4-phenyl-butan-1-one CAS Name: 4-phenyl-3-[1-(phenylmethyl)-3-indolyl]-1-[4-(phenylmethyl)-1-piperidinyl]-1-butanone IUPAC Name: 3-(1-benzylindol-3-yl)-1-(4-benzylpiperidin-1-yl)-4-phenylbutan-1-one Traditional Name: 3-(1-benzylindol-3-yl)-1-(4-benzylpiperidino)-4-phenyl-butan-1-one Formula: C37H38N2O MolecularWeight: 526.71042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CC(CC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CC(CC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C37H38N2O/c40-37(38-22-20-31(21-23-38)24-29-12-4-1-5-13-29)26-33(25-30-14-6-2-7-15-30)35-28-39(27-32-16-8-3-9-17-32)36-19-11-10-18-34(35)36/h1-19,28,31,33H,20-27H2