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

Systemtic Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylphenyl]-2-phenyl-ethanamide Openeye Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]phenyl]-2-phenyl-acetamide CAS Name: N-[4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]phenyl]-2-phenylacetamide IUPAC Name: N-[4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]phenyl]-2-phenylacetamide Traditional Name: 2-phenyl-N-[4-(4-piperonylpiperazine-1-carbonyl)phenyl]acetamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)NC(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C27H27N3O4/c31-26(17-20-4-2-1-3-5-20)28-23-9-7-22(8-10-23)27(32)30-14-12-29(13-15-30)18-21-6-11-24-25(16-21)34-19-33-24/h1-11,16H,12-15,17-19H2,(H,28,31)