(E)-N-[4-(1-adamantyl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(1-adamantyl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[4-(1-adamantyl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[4-(1-adamantyl)phenyl]-2-cyano-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[4-(1-adamantyl)phenyl]-2-cyano-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[4-(1-adamantyl)phenyl]-2-cyano-3-(4-methoxyphenyl)acrylamide Formula: C27H28N2O2 MolecularWeight: 412.52342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H28N2O2/c1-31-25-8-2-18(3-9-25)13-22(17-28)26(30)29-24-6-4-23(5-7-24)27-14-19-10-20(15-27)12-21(11-19)16-27/h2-9,13,19-21H,10-12,14-16H2,1H3,(H,29,30)/b22-13+