2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[2-(phenylmethyl)phenyl]propanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[2-(phenylmethyl)phenyl]propanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2-benzylphenyl)propanamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-[2-(phenylmethyl)phenyl]propanamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2-benzylphenyl)propanamide Traditional Name: N-(2-benzylphenyl)-2-(4-piperonylpiperazino)propionamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1CC2=CC=CC=C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1CC2=CC=CC=C2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H31N3O3/c1-21(28(32)29-25-10-6-5-9-24(25)17-22-7-3-2-4-8-22)31-15-13-30(14-16-31)19-23-11-12-26-27(18-23)34-20-33-26/h2-12,18,21H,13-17,19-20H2,1H3,(H,29,32)