3-[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide

Systemtic Name: 3-[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide Openeye Name: 3-[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide CAS Name: 3-[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-3-pyrrolyl]-2-cyano-N-(4-hydroxyphenyl)-2-propenamide IUPAC Name: 3-[1-[4-(1-adamantyl)phenyl]-2,5-dimethylpyrrol-3-yl]-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide Traditional Name: 3-[1-[4-(1-adamantyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(4-hydroxyphenyl)acrylamide Formula: C32H33N3O2 MolecularWeight: 491.62332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C)C=C(C#N)C(=O)NC6=CC=C(C=C6)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C)C=C(C#N)C(=O)NC6=CC=C(C=C6)O

InChI

InChI=1S/C32H33N3O2/c1-20-11-25(15-26(19-33)31(37)34-28-5-9-30(36)10-6-28)21(2)35(20)29-7-3-27(4-8-29)32-16-22-12-23(17-32)14-24(13-22)18-32/h3-11,15,22-24,36H,12-14,16-18H2,1-2H3,(H,34,37)