ethyl (E)-3-[4-[4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[4-[4-(2-bromo-4-isopropyl-phenoxy)butanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[4-(2-bromo-4-propan-2-ylphenoxy)-1-oxobutoxy]-3-methoxyphenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[4-(2-bromo-4-propan-2-ylphenoxy)butanoyloxy]-3-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-[4-(2-bromo-4-isopropyl-phenoxy)butanoyloxy]-3-methoxy-phenyl]-2-cyano-acrylic acid ethyl ester Formula: C26H28BrNO6 MolecularWeight: 530.40762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)OC(=O)CCCOC2=C(C=C(C=C2)C(C)C)Br)OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C=C1)OC(=O)CCCOC2=C(C=C(C=C2)C(C)C)Br)OC)/C#N

InChI

InChI=1S/C26H28BrNO6/c1-5-32-26(30)20(16-28)13-18-8-10-23(24(14-18)31-4)34-25(29)7-6-12-33-22-11-9-19(17(2)3)15-21(22)27/h8-11,13-15,17H,5-7,12H2,1-4H3/b20-13+