3-(3-bromanyl-5-methoxy-4-octoxy-phenyl)-2-cyano-N-phenyl-prop-2-enamide

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-octoxy-phenyl)-2-cyano-N-phenyl-prop-2-enamide Openeye Name: 3-(3-bromo-5-methoxy-4-octoxy-phenyl)-2-cyano-N-phenyl-prop-2-enamide CAS Name: 3-(3-bromo-5-methoxy-4-octoxyphenyl)-2-cyano-N-phenyl-2-propenamide IUPAC Name: 3-(3-bromo-5-methoxy-4-octoxyphenyl)-2-cyano-N-phenylprop-2-enamide Traditional Name: 3-(3-bromo-5-methoxy-4-octoxy-phenyl)-2-cyano-N-phenyl-acrylamide Formula: C25H29BrN2O3 MolecularWeight: 485.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2=CC=CC=C2)OC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2=CC=CC=C2)OC

InChI

InChI=1S/C25H29BrN2O3/c1-3-4-5-6-7-11-14-31-24-22(26)16-19(17-23(24)30-2)15-20(18-27)25(29)28-21-12-9-8-10-13-21/h8-10,12-13,15-17H,3-7,11,14H2,1-2H3,(H,28,29)