N-(1-phenylethyl)-1-(1-phenylprop-2-enyl)pyridin-1-ium-3-carboxamide chloride

Systemtic Name: N-(1-phenylethyl)-1-(1-phenylprop-2-enyl)pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-(1-phenylallyl)-N-(1-phenylethyl)pyridin-1-ium-3-carboxamide chloride CAS Name: N-(1-phenylethyl)-1-(1-phenylprop-2-enyl)-3-pyridin-1-iumcarboxamide chloride IUPAC Name: N-(1-phenylethyl)-1-(1-phenylprop-2-enyl)pyridin-1-ium-3-carboxamide chloride Traditional Name: 1-(1-phenylallyl)-N-(1-phenylethyl)pyridin-1-ium-3-carboxamide chloride Formula: C23H23ClN2O MolecularWeight: 378.89452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=C[N+](=CC=C2)C(C=C)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=C[N+](=CC=C2)C(C=C)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C23H22N2O.ClH/c1-3-22(20-13-8-5-9-14-20)25-16-10-15-21(17-25)23(26)24-18(2)19-11-6-4-7-12-19;/h3-18,22H,1H2,2H3;1H