3-tert-butyl-2-ethyl-6-methoxy-4-phenyl-isoquinolin-1-one

Systemtic Name: 3-tert-butyl-2-ethyl-6-methoxy-4-phenyl-isoquinolin-1-one Openeye Name: 3-tert-butyl-2-ethyl-6-methoxy-4-phenyl-isoquinolin-1-one CAS Name: 3-tert-butyl-2-ethyl-6-methoxy-4-phenyl-1-isoquinolinone IUPAC Name: 3-tert-butyl-2-ethyl-6-methoxy-4-phenylisoquinolin-1-one Traditional Name: 3-tert-butyl-2-ethyl-6-methoxy-4-phenyl-isocarbostyril Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CCN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C22H25NO2/c1-6-23-20(22(2,3)4)19(15-10-8-7-9-11-15)18-14-16(25-5)12-13-17(18)21(23)24/h7-14H,6H2,1-5H3