(E)-3-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxy-3-bromo-5-ethoxy-phenyl)-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide CAS Name: (E)-3-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-2-cyano-N-(3-ethoxyphenyl)-2-propenamide IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxy-3-bromo-5-ethoxy-phenyl)-2-cyano-N-m-phenetyl-acrylamide Formula: C27H25BrN2O4 MolecularWeight: 521.4024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C(=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OCC)C#N

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)/C(=C/C2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OCC)/C#N

InChI

InChI=1S/C27H25BrN2O4/c1-3-32-23-12-8-11-22(16-23)30-27(31)21(17-29)13-20-14-24(28)26(25(15-20)33-4-2)34-18-19-9-6-5-7-10-19/h5-16H,3-4,18H2,1-2H3,(H,30,31)/b21-13+