(Z)-3-[2-bromanyl-5-ethoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]-2-cyano-N-phenethyl-prop-2-enamide

Systemtic Name: (Z)-3-[2-bromanyl-5-ethoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]-2-cyano-N-phenethyl-prop-2-enamide Openeye Name: (Z)-3-[4-(2-anilino-2-oxo-ethoxy)-2-bromo-5-ethoxy-phenyl]-2-cyano-N-phenethyl-prop-2-enamide CAS Name: (Z)-3-[4-(2-anilino-2-oxoethoxy)-2-bromo-5-ethoxyphenyl]-2-cyano-N-phenethyl-2-propenamide IUPAC Name: (Z)-3-[4-(2-anilino-2-oxoethoxy)-2-bromo-5-ethoxyphenyl]-2-cyano-N-phenethylprop-2-enamide Traditional Name: (Z)-3-[4-(2-anilino-2-keto-ethoxy)-2-bromo-5-ethoxy-phenyl]-2-cyano-N-phenethyl-acrylamide Formula: C28H26BrN3O4 MolecularWeight: 548.42774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=C(C#N)C(=O)NCCC2=CC=CC=C2)Br)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=C(C(=C1)/C=C(/C#N)\C(=O)NCCC2=CC=CC=C2)Br)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C28H26BrN3O4/c1-2-35-25-16-21(15-22(18-30)28(34)31-14-13-20-9-5-3-6-10-20)24(29)17-26(25)36-19-27(33)32-23-11-7-4-8-12-23/h3-12,15-17H,2,13-14,19H2,1H3,(H,31,34)(H,32,33)/b22-15-