3-(1,3-benzodioxol-5-yl)-1-[4-(2-chlorophenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2-chlorophenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2-chlorophenyl)piperazin-1-yl]propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2-chlorophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2-chlorophenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2-chlorophenyl)piperazino]propan-1-one Formula: C20H21ClN2O3 MolecularWeight: 372.84534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21ClN2O3/c21-16-3-1-2-4-17(16)22-9-11-23(12-10-22)20(24)8-6-15-5-7-18-19(13-15)26-14-25-18/h1-5,7,13H,6,8-12,14H2