ethyl (E)-3-[4-[(4-bromophenyl)methoxy]-3-methoxy-5-prop-2-enyl-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[(4-bromophenyl)methoxy]-3-methoxy-5-prop-2-enyl-phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[3-allyl-4-[(4-bromophenyl)methoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[(4-bromophenyl)methoxy]-3-methoxy-5-prop-2-enylphenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[(4-bromophenyl)methoxy]-3-methoxy-5-prop-2-enylphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-allyl-4-(4-bromobenzyl)oxy-5-methoxy-phenyl]-2-cyano-acrylic acid ethyl ester Formula: C23H22BrNO4 MolecularWeight: 456.32908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C(=C1)OC)OCC2=CC=C(C=C2)Br)CC=C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C(=C1)OC)OCC2=CC=C(C=C2)Br)CC=C)/C#N

InChI

InChI=1S/C23H22BrNO4/c1-4-6-18-11-17(12-19(14-25)23(26)28-5-2)13-21(27-3)22(18)29-15-16-7-9-20(24)10-8-16/h4,7-13H,1,5-6,15H2,2-3H3/b19-12+