(E)-2-cyano-N-quinolin-5-yl-3-(2,4,5-trimethoxyphenyl)prop-2-enamide hydrochloride

Systemtic Name: (E)-2-cyano-N-quinolin-5-yl-3-(2,4,5-trimethoxyphenyl)prop-2-enamide hydrochloride Openeye Name: (E)-2-cyano-N-(5-quinolyl)-3-(2,4,5-trimethoxyphenyl)prop-2-enamide hydrochloride CAS Name: (E)-2-cyano-N-(5-quinolinyl)-3-(2,4,5-trimethoxyphenyl)-2-propenamide hydrochloride IUPAC Name: (E)-2-cyano-N-quinolin-5-yl-3-(2,4,5-trimethoxyphenyl)prop-2-enamide hydrochloride Traditional Name: (E)-3-asaryl-2-cyano-N-(5-quinolyl)acrylamide hydrochloride Formula: C22H20ClN3O4 MolecularWeight: 425.8649

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=C(C#N)C(=O)NC2=CC=CC3=C2C=CC=N3)OC)OC.Cl

Isomeric SMILES

COC1=CC(=C(C=C1/C=C(\C#N)/C(=O)NC2=CC=CC3=C2C=CC=N3)OC)OC.Cl

InChI

InChI=1S/C22H19N3O4.ClH/c1-27-19-12-21(29-3)20(28-2)11-14(19)10-15(13-23)22(26)25-18-8-4-7-17-16(18)6-5-9-24-17;/h4-12H,1-3H3,(H,25,26);1H/b15-10+;