3-(3-bromanyl-5-ethoxy-4-hexoxy-phenyl)-2-cyano-N-(3-methylphenyl)prop-2-enamide

Systemtic Name: 3-(3-bromanyl-5-ethoxy-4-hexoxy-phenyl)-2-cyano-N-(3-methylphenyl)prop-2-enamide Openeye Name: 3-(3-bromo-5-ethoxy-4-hexoxy-phenyl)-2-cyano-N-(m-tolyl)prop-2-enamide CAS Name: 3-(3-bromo-5-ethoxy-4-hexoxyphenyl)-2-cyano-N-(3-methylphenyl)-2-propenamide IUPAC Name: 3-(3-bromo-5-ethoxy-4-hexoxyphenyl)-2-cyano-N-(3-methylphenyl)prop-2-enamide Traditional Name: 3-(3-bromo-5-ethoxy-4-hexoxy-phenyl)-2-cyano-N-(m-tolyl)acrylamide Formula: C25H29BrN2O3 MolecularWeight: 485.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2=CC=CC(=C2)C)OCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2=CC=CC(=C2)C)OCC

InChI

InChI=1S/C25H29BrN2O3/c1-4-6-7-8-12-31-24-22(26)15-19(16-23(24)30-5-2)14-20(17-27)25(29)28-21-11-9-10-18(3)13-21/h9-11,13-16H,4-8,12H2,1-3H3,(H,28,29)