(E)-N-(2-methyl-1-phenyl-2-piperidin-1-ium-1-yl-propylidene)-3-phenyl-prop-2-enamide chloride

Systemtic Name: (E)-N-(2-methyl-1-phenyl-2-piperidin-1-ium-1-yl-propylidene)-3-phenyl-prop-2-enamide chloride Openeye Name: (E)-N-(2-methyl-1-phenyl-2-piperidin-1-ium-1-yl-propylidene)-3-phenyl-prop-2-enamide chloride CAS Name: (E)-N-[2-methyl-1-phenyl-2-(1-piperidin-1-iumyl)propylidene]-3-phenyl-2-propenamide chloride IUPAC Name: (E)-N-(2-methyl-1-phenyl-2-piperidin-1-ium-1-ylpropylidene)-3-phenylprop-2-enamide chloride Traditional Name: (E)-N-(2-methyl-1-phenyl-2-piperidin-1-ium-1-yl-propylidene)-3-phenyl-acrylamide chloride Formula: C24H29ClN2O MolecularWeight: 396.95286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=NC(=O)C=CC1=CC=CC=C1)C2=CC=CC=C2)[NH+]3CCCCC3.[Cl-]

Isomeric SMILES

CC(C)(C(=NC(=O)/C=C/C1=CC=CC=C1)C2=CC=CC=C2)[NH+]3CCCCC3.[Cl-]

InChI

InChI=1S/C24H28N2O.ClH/c1-24(2,26-18-10-5-11-19-26)23(21-14-8-4-9-15-21)25-22(27)17-16-20-12-6-3-7-13-20;/h3-4,6-9,12-17H,5,10-11,18-19H2,1-2H3;1H/b17-16+,25-23?;