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

Systemtic Name: (E)-2-cyano-3-(2,4-dimethylphenyl)-N-quinolin-5-yl-prop-2-enamide hydrochloride Openeye Name: (E)-2-cyano-3-(2,4-dimethylphenyl)-N-(5-quinolyl)prop-2-enamide hydrochloride CAS Name: (E)-2-cyano-3-(2,4-dimethylphenyl)-N-(5-quinolinyl)-2-propenamide hydrochloride IUPAC Name: (E)-2-cyano-3-(2,4-dimethylphenyl)-N-quinolin-5-ylprop-2-enamide hydrochloride Traditional Name: (E)-2-cyano-3-(2,4-dimethylphenyl)-N-(5-quinolyl)acrylamide hydrochloride Formula: C21H18ClN3O MolecularWeight: 363.84012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC3=C2C=CC=N3)C.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=CC3=C2C=CC=N3)C.Cl

InChI

InChI=1S/C21H17N3O.ClH/c1-14-8-9-16(15(2)11-14)12-17(13-22)21(25)24-20-7-3-6-19-18(20)5-4-10-23-19;/h3-12H,1-2H3,(H,24,25);1H/b17-12+;