[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-phenylmethoxyphenyl)methanone hydrochloride

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-phenylmethoxyphenyl)methanone hydrochloride Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-benzyloxyphenyl)methanone hydrochloride CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(2-phenylmethoxyphenyl)methanone hydrochloride IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2-phenylmethoxyphenyl)methanone hydrochloride Traditional Name: (2-benzoxyphenyl)-(4-piperonylpiperazino)methanone hydrochloride Formula: C26H27ClN2O4 MolecularWeight: 466.95658

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4OCC5=CC=CC=C5.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4OCC5=CC=CC=C5.Cl

InChI

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