4-azanyl-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethyl]benzamide trihydrochloride

Systemtic Name: 4-azanyl-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethyl]benzamide trihydrochloride Openeye Name: 4-amino-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethyl]benzamide trihydrochloride CAS Name: 4-amino-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]ethyl]benzamide trihydrochloride IUPAC Name: 4-amino-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethyl]benzamide trihydrochloride Traditional Name: 4-amino-N-[2-(4-piperonylpiperazino)ethyl]benzamide trihydrochloride Formula: C21H29Cl3N4O3 MolecularWeight: 491.83896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC=C(C=C2)N)CC3=CC4=C(C=C3)OCO4.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC=C(C=C2)N)CC3=CC4=C(C=C3)OCO4.Cl.Cl.Cl

InChI

InChI=1S/C21H26N4O3.3ClH/c22-18-4-2-17(3-5-18)21(26)23-7-8-24-9-11-25(12-10-24)14-16-1-6-19-20(13-16)28-15-27-19;;;/h1-6,13H,7-12,14-15,22H2,(H,23,26);3*1H