3-(2-chlorophenyl)-2-phenyl-N-(pyridin-1-ium-2-ylmethyl)prop-2-enamide

Systemtic Name: 3-(2-chlorophenyl)-2-phenyl-N-(pyridin-1-ium-2-ylmethyl)prop-2-enamide Openeye Name: 3-(2-chlorophenyl)-2-phenyl-N-(pyridin-1-ium-2-ylmethyl)prop-2-enamide CAS Name: 3-(2-chlorophenyl)-2-phenyl-N-(2-pyridin-1-iumylmethyl)-2-propenamide IUPAC Name: 3-(2-chlorophenyl)-2-phenyl-N-(pyridin-1-ium-2-ylmethyl)prop-2-enamide Traditional Name: 3-(2-chlorophenyl)-2-phenyl-N-(pyridin-1-ium-2-ylmethyl)acrylamide Formula: C21H18ClN2O+ MolecularWeight: 349.83342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC2=CC=CC=C2Cl)C(=O)NCC3=CC=CC=[NH+]3

Isomeric SMILES

C1=CC=C(C=C1)C(=CC2=CC=CC=C2Cl)C(=O)NCC3=CC=CC=[NH+]3

InChI

InChI=1S/C21H17ClN2O/c22-20-12-5-4-10-17(20)14-19(16-8-2-1-3-9-16)21(25)24-15-18-11-6-7-13-23-18/h1-14H,15H2,(H,24,25)/p+1