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

Systemtic Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-[4-(3-phenyl-1-adamantyl)phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-[4-(3-phenyl-1-adamantyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-[4-(3-phenyl-1-adamantyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-[4-(3-phenyl-1-adamantyl)phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-methoxyphenyl)-N-[4-(3-phenyl-1-adamantyl)phenyl]acrylamide Formula: C33H32N2O2 MolecularWeight: 488.61938

Click to see the large picture

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)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)(C4)C6=CC=CC=C6

InChI

InChI=1S/C33H32N2O2/c1-37-30-13-7-23(8-14-30)16-26(21-34)31(36)35-29-11-9-28(10-12-29)33-19-24-15-25(20-33)18-32(17-24,22-33)27-5-3-2-4-6-27/h2-14,16,24-25H,15,17-20,22H2,1H3,(H,35,36)/b26-16+