(E)-N-[(1-methylpiperidin-1-ium-3-yl)methyl]-N,3-diphenyl-prop-2-enamide chloride

Systemtic Name: (E)-N-[(1-methylpiperidin-1-ium-3-yl)methyl]-N,3-diphenyl-prop-2-enamide chloride Openeye Name: (E)-N-[(1-methylpiperidin-1-ium-3-yl)methyl]-N,3-diphenyl-prop-2-enamide chloride CAS Name: (E)-N-[(1-methyl-3-piperidin-1-iumyl)methyl]-N,3-diphenyl-2-propenamide chloride IUPAC Name: (E)-N-[(1-methylpiperidin-1-ium-3-yl)methyl]-N,3-diphenylprop-2-enamide chloride Traditional Name: (E)-N-[(1-methylpiperidin-1-ium-3-yl)methyl]-N,3-diphenyl-acrylamide chloride Formula: C22H27ClN2O MolecularWeight: 370.91558

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)CN(C2=CC=CC=C2)C(=O)C=CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C[NH+]1CCCC(C1)CN(C2=CC=CC=C2)C(=O)/C=C/C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C22H26N2O.ClH/c1-23-16-8-11-20(17-23)18-24(21-12-6-3-7-13-21)22(25)15-14-19-9-4-2-5-10-19;/h2-7,9-10,12-15,20H,8,11,16-18H2,1H3;1H/b15-14+;