2-(2-methylheptan-2-yl)-1,2-benzothiazol-3-one

Systemtic Name: 2-(2-methylheptan-2-yl)-1,2-benzothiazol-3-one Openeye Name: 2-(1,1-dimethylhexyl)-1,2-benzothiazol-3-one CAS Name: 2-(2-methylheptan-2-yl)-1,2-benzothiazol-3-one IUPAC Name: 2-(2-methylheptan-2-yl)-1,2-benzothiazol-3-one Traditional Name: 2-(1,1-dimethylhexyl)-1,2-benzothiazol-3-one Formula: C15H21NOS MolecularWeight: 263.39834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)N1C(=O)C2=CC=CC=C2S1

Isomeric SMILES

CCCCCC(C)(C)N1C(=O)C2=CC=CC=C2S1

InChI

InChI=1S/C15H21NOS/c1-4-5-8-11-15(2,3)16-14(17)12-9-6-7-10-13(12)18-16/h6-7,9-10H,4-5,8,11H2,1-3H3