1,1,1-tris(chloranyl)-3-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)propan-2-one

Systemtic Name: 1,1,1-tris(chloranyl)-3-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)propan-2-one Openeye Name: 1,1,1-trichloro-3-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)propan-2-one CAS Name: 1,1,1-trichloro-3-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)-2-propanone IUPAC Name: 1,1,1-trichloro-3-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)propan-2-one Traditional Name: 1,1,1-trichloro-3-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)acetone Formula: C16H18Cl3NO3 MolecularWeight: 378.67802

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C(=N1)CC(=O)C(Cl)(Cl)Cl)OC)OC)C

Isomeric SMILES

CC1(CC2=CC(=C(C=C2C(=N1)CC(=O)C(Cl)(Cl)Cl)OC)OC)C

InChI

InChI=1S/C16H18Cl3NO3/c1-15(2)8-9-5-12(22-3)13(23-4)6-10(9)11(20-15)7-14(21)16(17,18)19/h5-6H,7-8H2,1-4H3