3-(1,3-benzodioxol-5-yl)-N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[5-chloro-2-(4-methylpiperazino)phenyl]propionamide Formula: C21H24ClN3O3 MolecularWeight: 401.88656

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

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