(E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-N-(3-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-N-(3-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-N-(3-chloro-2-methyl-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-N-(3-chloro-2-methylphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-N-(3-chloro-2-methylphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-N-(3-chloro-2-methyl-phenyl)-2-cyano-acrylamide Formula: C21H18BrClN2O3 MolecularWeight: 461.73622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(=CC2=CC(=C(C(=C2)Br)OCC=C)OC)C#N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)/C(=C/C2=CC(=C(C(=C2)Br)OCC=C)OC)/C#N

InChI

InChI=1S/C21H18BrClN2O3/c1-4-8-28-20-16(22)10-14(11-19(20)27-3)9-15(12-24)21(26)25-18-7-5-6-17(23)13(18)2/h4-7,9-11H,1,8H2,2-3H3,(H,25,26)/b15-9+