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

Systemtic Name: (E)-2-cyano-3-(2-phenylmethoxyphenyl)-N-pyridin-2-yl-prop-2-enamide hydrochloride Openeye Name: (E)-3-(2-benzyloxyphenyl)-2-cyano-N-(2-pyridyl)prop-2-enamide hydrochloride CAS Name: (E)-2-cyano-3-(2-phenylmethoxyphenyl)-N-(2-pyridinyl)-2-propenamide hydrochloride IUPAC Name: (E)-2-cyano-3-(2-phenylmethoxyphenyl)-N-pyridin-2-ylprop-2-enamide hydrochloride Traditional Name: (E)-3-(2-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=C2C=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)25-21-12-6-7-13-24-21)14-18-10-4-5-11-20(18)27-16-17-8-2-1-3-9-17;/h1-14H,16H2,(H,24,25,26);1H/b19-14+;