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

Systemtic Name: (E)-N-(4-butylphenyl)-2-cyano-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-enamide Openeye Name: (E)-N-(4-butylphenyl)-2-cyano-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-enamide CAS Name: (E)-N-(4-butylphenyl)-2-cyano-3-[4-methoxy-3-(phenoxymethyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(4-butylphenyl)-2-cyano-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-enamide Traditional Name: (E)-N-(4-butylphenyl)-2-cyano-3-[4-methoxy-3-(phenoxymethyl)phenyl]acrylamide Formula: C28H28N2O3 MolecularWeight: 440.53352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OC)COC3=CC=CC=C3)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OC)COC3=CC=CC=C3)/C#N

InChI

InChI=1S/C28H28N2O3/c1-3-4-8-21-11-14-25(15-12-21)30-28(31)23(19-29)17-22-13-16-27(32-2)24(18-22)20-33-26-9-6-5-7-10-26/h5-7,9-18H,3-4,8,20H2,1-2H3,(H,30,31)/b23-17+