(E)-3-[3-[(3-bromophenyl)methoxy]-4-methoxy-phenyl]-N-(4-butylphenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-[3-[(3-bromophenyl)methoxy]-4-methoxy-phenyl]-N-(4-butylphenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-[3-[(3-bromophenyl)methoxy]-4-methoxy-phenyl]-N-(4-butylphenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-[3-[(3-bromophenyl)methoxy]-4-methoxyphenyl]-N-(4-butylphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-[3-[(3-bromophenyl)methoxy]-4-methoxyphenyl]-N-(4-butylphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-[3-(3-bromobenzyl)oxy-4-methoxy-phenyl]-N-(4-butylphenyl)-2-cyano-acrylamide Formula: C28H27BrN2O3 MolecularWeight: 519.42958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OC)OCC3=CC(=CC=C3)Br)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OC)OCC3=CC(=CC=C3)Br)/C#N

InChI

InChI=1S/C28H27BrN2O3/c1-3-4-6-20-9-12-25(13-10-20)31-28(32)23(18-30)15-21-11-14-26(33-2)27(17-21)34-19-22-7-5-8-24(29)16-22/h5,7-17H,3-4,6,19H2,1-2H3,(H,31,32)/b23-15+