(E)-3-(3,5-dimethoxyphenyl)-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(3,5-dimethoxyphenyl)-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(3,5-dimethoxyphenyl)-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(3,5-dimethoxyphenyl)-N-[3-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3,5-dimethoxyphenyl)-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(3,5-dimethoxyphenyl)-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acrylamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C=CC2=CC(=CC(=C2)OC)OC)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)/C=C/C2=CC(=CC(=C2)OC)OC)N3CC[NH+](CC3)C

InChI

InChI=1S/C23H29N3O3/c1-17-13-19(6-7-22(17)26-11-9-25(2)10-12-26)24-23(27)8-5-18-14-20(28-3)16-21(15-18)29-4/h5-8,13-16H,9-12H2,1-4H3,(H,24,27)/p+1/b8-5+