(E)-N-(2-butoxyphenyl)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(2-butoxyphenyl)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-(2-butoxyphenyl)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(2-butoxyphenyl)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(2-butoxyphenyl)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(2-butoxyphenyl)-2-cyano-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)NC2=CC=CC=C2OCCCC)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=CC=C2OCCCC)OC

InChI

InChI=1S/C27H34N2O4/c1-4-6-8-11-17-33-25-15-14-21(19-26(25)31-3)18-22(20-28)27(30)29-23-12-9-10-13-24(23)32-16-7-5-2/h9-10,12-15,18-19H,4-8,11,16-17H2,1-3H3,(H,29,30)/b22-18+