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

Systemtic Name: (E)-3-(3-methoxyphenyl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(3-methoxyphenyl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(3-methoxyphenyl)-N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3-methoxyphenyl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(3-methoxyphenyl)-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acrylamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C=CC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)/C=C/C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H27N3O2/c1-17-15-19(25-13-11-24(2)12-14-25)8-9-21(17)23-22(26)10-7-18-5-4-6-20(16-18)27-3/h4-10,15-16H,11-14H2,1-3H3,(H,23,26)/p+1/b10-7+