(E)-3-(2-ethyl-1-benzofuran-3-yl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide

Systemtic Name: (E)-3-(2-ethyl-1-benzofuran-3-yl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide Openeye Name: (E)-3-(2-ethylbenzofuran-3-yl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide CAS Name: (E)-3-(2-ethyl-3-benzofuranyl)-N-(4-methyl-1-piperazin-4-iumyl)-2-propenamide IUPAC Name: (E)-3-(2-ethyl-1-benzofuran-3-yl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide Traditional Name: (E)-3-(2-ethylbenzofuran-3-yl)-N-(4-methylpiperazin-4-ium-1-yl)acrylamide Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=CC(=O)NN3CC[NH+](CC3)C

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=C/C(=O)NN3CC[NH+](CC3)C

InChI

InChI=1S/C18H23N3O2/c1-3-16-15(14-6-4-5-7-17(14)23-16)8-9-18(22)19-21-12-10-20(2)11-13-21/h4-9H,3,10-13H2,1-2H3,(H,19,22)/p+1/b9-8+