(E)-3-(2-methoxy-5-methyl-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide

Systemtic Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide Openeye Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide CAS Name: (E)-3-(2-methoxy-5-methylphenyl)-N-(4-methyl-1-piperazin-4-iumyl)-2-propenamide IUPAC Name: (E)-3-(2-methoxy-5-methylphenyl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide Traditional Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)acrylamide Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)NN2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C=C/C(=O)NN2CC[NH+](CC2)C

InChI

InChI=1S/C16H23N3O2/c1-13-4-6-15(21-3)14(12-13)5-7-16(20)17-19-10-8-18(2)9-11-19/h4-7,12H,8-11H2,1-3H3,(H,17,20)/p+1/b7-5+