3-[4-[4-[2-(1,3-benzodioxol-5-yloxy)phenyl]piperazin-1-yl]butyl]-1H-indole

Systemtic Name: 3-[4-[4-[2-(1,3-benzodioxol-5-yloxy)phenyl]piperazin-1-yl]butyl]-1H-indole Openeye Name: 3-[4-[4-[2-(1,3-benzodioxol-5-yloxy)phenyl]piperazin-1-yl]butyl]-1H-indole CAS Name: 3-[4-[4-[2-(1,3-benzodioxol-5-yloxy)phenyl]-1-piperazinyl]butyl]-1H-indole IUPAC Name: 3-[4-[4-[2-(1,3-benzodioxol-5-yloxy)phenyl]piperazin-1-yl]butyl]-1H-indole Traditional Name: 3-[4-[4-[2-(1,3-benzodioxol-5-yloxy)phenyl]piperazino]butyl]-1H-indole Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CNC3=CC=CC=C32)C4=CC=CC=C4OC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN(CCN1CCCCC2=CNC3=CC=CC=C32)C4=CC=CC=C4OC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H31N3O3/c1-2-9-25-24(8-1)22(20-30-25)7-5-6-14-31-15-17-32(18-16-31)26-10-3-4-11-27(26)35-23-12-13-28-29(19-23)34-21-33-28/h1-4,8-13,19-20,30H,5-7,14-18,21H2