1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(7-ethyl-1H-indol-3-yl)-4-phenyl-butan-1-one

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(7-ethyl-1H-indol-3-yl)-4-phenyl-butan-1-one Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(7-ethyl-1H-indol-3-yl)-4-phenyl-butan-1-one CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-(7-ethyl-1H-indol-3-yl)-4-phenyl-1-butanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(7-ethyl-1H-indol-3-yl)-4-phenylbutan-1-one Traditional Name: 3-(7-ethyl-1H-indol-3-yl)-4-phenyl-1-(4-piperonylpiperazino)butan-1-one Formula: C32H35N3O3 MolecularWeight: 509.6386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(CC3=CC=CC=C3)CC(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(CC3=CC=CC=C3)CC(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C32H35N3O3/c1-2-25-9-6-10-27-28(20-33-32(25)27)26(17-23-7-4-3-5-8-23)19-31(36)35-15-13-34(14-16-35)21-24-11-12-29-30(18-24)38-22-37-29/h3-12,18,20,26,33H,2,13-17,19,21-22H2,1H3