6-isoquinolin-1-yl-2,2-dimethyl-5-phenyl-hexan-3-one

Systemtic Name: 6-isoquinolin-1-yl-2,2-dimethyl-5-phenyl-hexan-3-one Openeye Name: 6-(1-isoquinolyl)-2,2-dimethyl-5-phenyl-hexan-3-one CAS Name: 6-(1-isoquinolinyl)-2,2-dimethyl-5-phenyl-3-hexanone IUPAC Name: 6-isoquinolin-1-yl-2,2-dimethyl-5-phenylhexan-3-one Traditional Name: 6-(1-isoquinolyl)-2,2-dimethyl-5-phenyl-hexan-3-one Formula: C23H25NO MolecularWeight: 331.4507

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC(CC1=NC=CC2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)CC(CC1=NC=CC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C23H25NO/c1-23(2,3)22(25)16-19(17-9-5-4-6-10-17)15-21-20-12-8-7-11-18(20)13-14-24-21/h4-14,19H,15-16H2,1-3H3