(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-(2-methoxy-4-methylsulfonyl-phenyl)ethanone

Systemtic Name: (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-(2-methoxy-4-methylsulfonyl-phenyl)ethanone Openeye Name: (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-(2-methoxy-4-methylsulfonyl-phenyl)ethanone CAS Name: (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-(2-methoxy-4-methylsulfonylphenyl)ethanone IUPAC Name: (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-(2-methoxy-4-methylsulfonylphenyl)ethanone Traditional Name: (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-(4-mesyl-2-methoxy-phenyl)ethanone Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=CC(=O)C3=C(C=C(C=C3)S(=O)(=O)C)OC)N1)C

Isomeric SMILES

CC1(CC2=CC=CC=C2/C(=C/C(=O)C3=C(C=C(C=C3)S(=O)(=O)C)OC)/N1)C

InChI

InChI=1S/C21H23NO4S/c1-21(2)13-14-7-5-6-8-16(14)18(22-21)12-19(23)17-10-9-15(27(4,24)25)11-20(17)26-3/h5-12,22H,13H2,1-4H3/b18-12-