(E)-N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-ethyl-N-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidin-1-iumyl]methyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-(2-thienyl)acrylamide Formula: C21H35N3OS+2 MolecularWeight: 377.5871

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CC[NH+](CC1)C2CC[NH+](CC2)C)C(=O)C=CC3=CC=CS3

Isomeric SMILES

CCN(CC1CC[NH+](CC1)C2CC[NH+](CC2)C)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C21H33N3OS/c1-3-23(21(25)7-6-20-5-4-16-26-20)17-18-8-14-24(15-9-18)19-10-12-22(2)13-11-19/h4-7,16,18-19H,3,8-15,17H2,1-2H3/p+2/b7-6+