(E)-N-(4-methylpiperazin-1-ium-1-yl)-3-phenyl-prop-2-enamide chloride

Systemtic Name: (E)-N-(4-methylpiperazin-1-ium-1-yl)-3-phenyl-prop-2-enamide chloride Openeye Name: (E)-N-(4-methylpiperazin-1-ium-1-yl)-3-phenyl-prop-2-enamide chloride CAS Name: (E)-N-(4-methyl-1-piperazin-1-iumyl)-3-phenyl-2-propenamide chloride IUPAC Name: (E)-N-(4-methylpiperazin-1-ium-1-yl)-3-phenylprop-2-enamide chloride Traditional Name: (E)-N-(4-methylpiperazin-1-ium-1-yl)-3-phenyl-acrylamide chloride Formula: C14H20ClN3O MolecularWeight: 281.7811

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)NC(=O)C=CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CN1CC[NH+](CC1)NC(=O)/C=C/C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C14H19N3O.ClH/c1-16-9-11-17(12-10-16)15-14(18)8-7-13-5-3-2-4-6-13;/h2-8H,9-12H2,1H3,(H,15,18);1H/b8-7+;