(1E)-1-[2-(1-adamantyl)-2-oxidanylidene-ethylidene]-3,3-dimethyl-2,4-dihydroisoquinoline-6-carbaldehyde

Systemtic Name: (1E)-1-[2-(1-adamantyl)-2-oxidanylidene-ethylidene]-3,3-dimethyl-2,4-dihydroisoquinoline-6-carbaldehyde Openeye Name: (1E)-1-[2-(1-adamantyl)-2-oxo-ethylidene]-3,3-dimethyl-2,4-dihydroisoquinoline-6-carbaldehyde CAS Name: (1E)-1-[2-(1-adamantyl)-2-oxoethylidene]-3,3-dimethyl-2,4-dihydroisoquinoline-6-carboxaldehyde IUPAC Name: (1E)-1-[2-(1-adamantyl)-2-oxoethylidene]-3,3-dimethyl-2,4-dihydroisoquinoline-6-carbaldehyde Traditional Name: (1E)-1-[2-(1-adamantyl)-2-keto-ethylidene]-3,3-dimethyl-2,4-dihydroisoquinoline-6-carbaldehyde Formula: C24H29NO2 MolecularWeight: 363.49256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2)C=O)C(=CC(=O)C34CC5CC(C3)CC(C5)C4)N1)C

Isomeric SMILES

CC1(CC2=C(C=CC(=C2)C=O)/C(=C\C(=O)C34CC5CC(C3)CC(C5)C4)/N1)C

InChI

InChI=1S/C24H29NO2/c1-23(2)13-19-8-15(14-26)3-4-20(19)21(25-23)9-22(27)24-10-16-5-17(11-24)7-18(6-16)12-24/h3-4,8-9,14,16-18,25H,5-7,10-13H2,1-2H3/b21-9+