1-(1-adamantyl)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propan-1-one

Systemtic Name: 1-(1-adamantyl)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propan-1-one Openeye Name: 1-(1-adamantyl)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propan-1-one CAS Name: 1-(1-adamantyl)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-propanone IUPAC Name: 1-(1-adamantyl)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propan-1-one Traditional Name: 1-(1-adamantyl)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)propan-1-one Formula: C24H31NO MolecularWeight: 349.50904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(CC2=CC=CC=C21)(C)C)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C1=NC(CC2=CC=CC=C21)(C)C)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H31NO/c1-15(21-20-7-5-4-6-19(20)14-23(2,3)25-21)22(26)24-11-16-8-17(12-24)10-18(9-16)13-24/h4-7,15-18H,8-14H2,1-3H3