2-nitroso-1-phenyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)ethanone

Systemtic Name: 2-nitroso-1-phenyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)ethanone Openeye Name: 2-nitroso-1-phenyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)ethanone CAS Name: 2-nitroso-1-phenyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)ethanone IUPAC Name: 2-nitroso-1-phenyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)ethanone Traditional Name: 2-nitroso-1-phenyl-2-(3,3,6,7-tetramethyl-4H-isoquinolin-1-yl)ethanone Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CC(N=C2C(C(=O)C3=CC=CC=C3)N=O)(C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CC(N=C2C(C(=O)C3=CC=CC=C3)N=O)(C)C)C

InChI

InChI=1S/C21H22N2O2/c1-13-10-16-12-21(3,4)22-18(17(16)11-14(13)2)19(23-25)20(24)15-8-6-5-7-9-15/h5-11,19H,12H2,1-4H3