2-ethanoyl-4,4-dimethyl-1,3-dihydroisoquinoline-7-sulfonyl chloride

Systemtic Name: 2-ethanoyl-4,4-dimethyl-1,3-dihydroisoquinoline-7-sulfonyl chloride Openeye Name: 2-acetyl-4,4-dimethyl-1,3-dihydroisoquinoline-7-sulfonyl chloride CAS Name: 2-acetyl-4,4-dimethyl-1,3-dihydroisoquinoline-7-sulfonyl chloride IUPAC Name: 2-acetyl-4,4-dimethyl-1,3-dihydroisoquinoline-7-sulfonyl chloride Traditional Name: 2-acetyl-4,4-dimethyl-1,3-dihydroisoquinoline-7-sulfonyl chloride Formula: C13H16ClNO3S MolecularWeight: 301.78904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=C(C=CC(=C2)S(=O)(=O)Cl)C(C1)(C)C

Isomeric SMILES

CC(=O)N1CC2=C(C=CC(=C2)S(=O)(=O)Cl)C(C1)(C)C

InChI

InChI=1S/C13H16ClNO3S/c1-9(16)15-7-10-6-11(19(14,17)18)4-5-12(10)13(2,3)8-15/h4-6H,7-8H2,1-3H3