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

Systemtic Name: 4-azanyl-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethyl]-2-chloranyl-benzamide Openeye Name: 4-amino-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethyl]-2-chloro-benzamide CAS Name: 4-amino-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]ethyl]-2-chlorobenzamide IUPAC Name: 4-amino-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethyl]-2-chlorobenzamide Traditional Name: 4-amino-2-chloro-N-[2-(4-piperonylpiperazino)ethyl]benzamide Formula: C21H25ClN4O3 MolecularWeight: 416.9012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN4O3/c22-18-12-16(23)2-3-17(18)21(27)24-5-6-25-7-9-26(10-8-25)13-15-1-4-19-20(11-15)29-14-28-19/h1-4,11-12H,5-10,13-14,23H2,(H,24,27)