1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine

Systemtic Name: 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine Openeye Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-[(E)-cinnamyl]piperazine CAS Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine IUPAC Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine Traditional Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-[(E)-cinnamyl]piperazine Formula: C21H23ClN2O2 MolecularWeight: 370.87252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)CC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)CC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C21H23ClN2O2/c22-19-14-21-20(25-16-26-21)13-18(19)15-24-11-9-23(10-12-24)8-4-7-17-5-2-1-3-6-17/h1-7,13-14H,8-12,15-16H2/b7-4+