(E)-2-cyano-N-[2-(3,5-dimethylphenoxy)ethyl]-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-[2-(3,5-dimethylphenoxy)ethyl]-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-[2-(3,5-dimethylphenoxy)ethyl]-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-[2-(3,5-dimethylphenoxy)ethyl]-3-(4-hexoxy-3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-[2-(3,5-dimethylphenoxy)ethyl]-3-(4-hexoxy-3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-[2-(3,5-dimethylphenoxy)ethyl]-3-(4-hexoxy-3-methoxy-phenyl)acrylamide Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NCCOC2=CC(=CC(=C2)C)C)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NCCOC2=CC(=CC(=C2)C)C)OC

InChI

InChI=1S/C27H34N2O4/c1-5-6-7-8-12-33-25-10-9-22(18-26(25)31-4)17-23(19-28)27(30)29-11-13-32-24-15-20(2)14-21(3)16-24/h9-10,14-18H,5-8,11-13H2,1-4H3,(H,29,30)/b23-17+