(E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)-2-cyano-N-(2-methylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)-2-cyano-N-(2-methylphenyl)prop-2-enamide Openeye Name: (E)-3-(3-chloro-5-methoxy-4-propoxy-phenyl)-2-cyano-N-(o-tolyl)prop-2-enamide CAS Name: (E)-3-(3-chloro-5-methoxy-4-propoxyphenyl)-2-cyano-N-(2-methylphenyl)-2-propenamide IUPAC Name: (E)-3-(3-chloro-5-methoxy-4-propoxyphenyl)-2-cyano-N-(2-methylphenyl)prop-2-enamide Traditional Name: (E)-3-(3-chloro-5-methoxy-4-propoxy-phenyl)-2-cyano-N-(o-tolyl)acrylamide Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C=C(C#N)C(=O)NC2=CC=CC=C2C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)/C=C(\C#N)/C(=O)NC2=CC=CC=C2C)OC

InChI

InChI=1S/C21H21ClN2O3/c1-4-9-27-20-17(22)11-15(12-19(20)26-3)10-16(13-23)21(25)24-18-8-6-5-7-14(18)2/h5-8,10-12H,4,9H2,1-3H3,(H,24,25)/b16-10+