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

Systemtic Name: (E)-N-ethyl-N-[[1-(1-methylpiperidin-4-yl)piperidin-1-ium-4-yl]methyl]-3-pyridin-4-yl-prop-2-enamide Openeye Name: (E)-N-ethyl-N-[[1-(1-methyl-4-piperidyl)piperidin-1-ium-4-yl]methyl]-3-(4-pyridyl)prop-2-enamide CAS Name: (E)-N-ethyl-N-[[1-(1-methyl-4-piperidinyl)-4-piperidin-1-iumyl]methyl]-3-pyridin-4-yl-2-propenamide IUPAC Name: (E)-N-ethyl-N-[[1-(1-methylpiperidin-4-yl)piperidin-1-ium-4-yl]methyl]-3-pyridin-4-ylprop-2-enamide Traditional Name: (E)-N-ethyl-N-[[1-(1-methyl-4-piperidyl)piperidin-1-ium-4-yl]methyl]-3-(4-pyridyl)acrylamide Formula: C22H35N4O+ MolecularWeight: 371.5395

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CC[NH+](CC1)C2CCN(CC2)C)C(=O)C=CC3=CC=NC=C3

Isomeric SMILES

CCN(CC1CC[NH+](CC1)C2CCN(CC2)C)C(=O)/C=C/C3=CC=NC=C3

InChI

InChI=1S/C22H34N4O/c1-3-25(22(27)5-4-19-6-12-23-13-7-19)18-20-8-16-26(17-9-20)21-10-14-24(2)15-11-21/h4-7,12-13,20-21H,3,8-11,14-18H2,1-2H3/p+1/b5-4+