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

Systemtic Name: (E)-3-(3-chlorophenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(3-chlorophenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(3-chlorophenyl)-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3-chlorophenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(3-chlorophenyl)-N-[4-(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=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O/c1-23-11-13-24(14-12-23)19-8-6-18(7-9-19)22-20(25)10-5-16-3-2-4-17(21)15-16/h2-10,15H,11-14H2,1H3,(H,22,25)/p+1/b10-5+