[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-benzyloxyphenyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(3-phenylmethoxyphenyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone Traditional Name: (3-benzoxyphenyl)-(4-piperonylpiperazino)methanone Formula: C26H26N2O4 MolecularWeight: 430.49564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C26H26N2O4/c29-26(22-7-4-8-23(16-22)30-18-20-5-2-1-3-6-20)28-13-11-27(12-14-28)17-21-9-10-24-25(15-21)32-19-31-24/h1-10,15-16H,11-14,17-19H2