(E)-2-cyano-3-(3-phenylmethoxyphenyl)-N-pyridin-2-yl-prop-2-enamide hydrochloride

Systemtic Name: (E)-2-cyano-3-(3-phenylmethoxyphenyl)-N-pyridin-2-yl-prop-2-enamide hydrochloride Openeye Name: (E)-3-(3-benzyloxyphenyl)-2-cyano-N-(2-pyridyl)prop-2-enamide hydrochloride CAS Name: (E)-2-cyano-3-(3-phenylmethoxyphenyl)-N-(2-pyridinyl)-2-propenamide hydrochloride IUPAC Name: (E)-2-cyano-3-(3-phenylmethoxyphenyl)-N-pyridin-2-ylprop-2-enamide hydrochloride Traditional Name: (E)-3-(3-benzoxyphenyl)-2-cyano-N-(2-pyridyl)acrylamide hydrochloride Formula: C22H18ClN3O2 MolecularWeight: 391.85022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C=C(C#N)C(=O)NC3=CC=CC=N3.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)/C=C(\C#N)/C(=O)NC3=CC=CC=N3.Cl

InChI

InChI=1S/C22H17N3O2.ClH/c23-15-19(22(26)25-21-11-4-5-12-24-21)13-18-9-6-10-20(14-18)27-16-17-7-2-1-3-8-17;/h1-14H,16H2,(H,24,25,26);1H/b19-13+;