2-benzo[g][1,3]benzothiazol-2-yl-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-benzo[g][1,3]benzothiazol-2-yl-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-benzo[g][1,3]benzothiazol-2-yl-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(2-benzo[g][1,3]benzothiazolyl)-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-benzo[g][1,3]benzothiazol-2-yl-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-benzo[g][1,3]benzothiazol-2-yl-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C19H17NO2S MolecularWeight: 323.40878

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C2=NC3=C(S2)C4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C2=NC3=C(S2)C4=CC=CC=C4C=C3)C

InChI

InChI=1S/C19H17NO2S/c1-19(2)9-14(21)16(15(22)10-19)18-20-13-8-7-11-5-3-4-6-12(11)17(13)23-18/h3-8,16H,9-10H2,1-2H3