6-tert-butylsulfonyl-1-methyl-isoquinoline

Systemtic Name: 6-tert-butylsulfonyl-1-methyl-isoquinoline Openeye Name: 6-tert-butylsulfonyl-1-methyl-isoquinoline CAS Name: 6-tert-butylsulfonyl-1-methylisoquinoline IUPAC Name: 6-tert-butylsulfonyl-1-methylisoquinoline Traditional Name: 6-tert-butylsulfonyl-1-methyl-isoquinoline Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC2=C1C=CC(=C2)S(=O)(=O)C(C)(C)C

Isomeric SMILES

CC1=NC=CC2=C1C=CC(=C2)S(=O)(=O)C(C)(C)C

InChI

InChI=1S/C14H17NO2S/c1-10-13-6-5-12(9-11(13)7-8-15-10)18(16,17)14(2,3)4/h5-9H,1-4H3