N-(1,3-benzodioxol-5-yl)-2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[4-(4-chlorobenzyl)piperazino]propionamide Formula: C21H24ClN3O3 MolecularWeight: 401.88656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)N3CCN(CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)N3CCN(CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H24ClN3O3/c1-15(21(26)23-18-6-7-19-20(12-18)28-14-27-19)25-10-8-24(9-11-25)13-16-2-4-17(22)5-3-16/h2-7,12,15H,8-11,13-14H2,1H3,(H,23,26)