(1E)-1-[2-(1-adamantyl)-2-oxidanylidene-ethylidene]-6-chloranyl-3,3-dimethyl-2,4-dihydroisoquinoline-7-carbaldehyde

Systemtic Name: (1E)-1-[2-(1-adamantyl)-2-oxidanylidene-ethylidene]-6-chloranyl-3,3-dimethyl-2,4-dihydroisoquinoline-7-carbaldehyde Openeye Name: (1E)-1-[2-(1-adamantyl)-2-oxo-ethylidene]-6-chloro-3,3-dimethyl-2,4-dihydroisoquinoline-7-carbaldehyde CAS Name: (1E)-1-[2-(1-adamantyl)-2-oxoethylidene]-6-chloro-3,3-dimethyl-2,4-dihydroisoquinoline-7-carboxaldehyde IUPAC Name: (1E)-1-[2-(1-adamantyl)-2-oxoethylidene]-6-chloro-3,3-dimethyl-2,4-dihydroisoquinoline-7-carbaldehyde Traditional Name: (1E)-1-[2-(1-adamantyl)-2-keto-ethylidene]-6-chloro-3,3-dimethyl-2,4-dihydroisoquinoline-7-carbaldehyde Formula: C24H28ClNO2 MolecularWeight: 397.93762

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C(=CC(=O)C34CC5CC(C3)CC(C5)C4)N1)C=O)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C24H28ClNO2/c1-23(2)12-17-7-20(25)18(13-27)6-19(17)21(26-23)8-22(28)24-9-14-3-15(10-24)5-16(4-14)11-24/h6-8,13-16,26H,3-5,9-12H2,1-2H3/b21-8+