(E)-3-(4-chlorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(4-chlorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(4-chlorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(4-chlorophenyl)-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(4-chlorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(4-chlorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]acrylamide Formula: C20H23ClN3O+ MolecularWeight: 356.86912

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClN3O/c1-23-12-14-24(15-13-23)19-5-3-2-4-18(19)22-20(25)11-8-16-6-9-17(21)10-7-16/h2-11H,12-15H2,1H3,(H,22,25)/p+1/b11-8+