2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-pentan-1-one

Systemtic Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-pentan-1-one Openeye Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-pentan-1-one CAS Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-1-pentanone IUPAC Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenylpentan-1-one Traditional Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-1-phenyl-pentan-1-one Formula: C22H25NO MolecularWeight: 319.44

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NC(CC2=CC=CC=C21)(C)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC(C1=NC(CC2=CC=CC=C21)(C)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO/c1-4-10-19(21(24)16-11-6-5-7-12-16)20-18-14-9-8-13-17(18)15-22(2,3)23-20/h5-9,11-14,19H,4,10,15H2,1-3H3