2-[[3-tert-butyl-5-(2-methyl-1-oxidanyl-propan-2-yl)-4-oxidanyl-phenyl]-oxidanyl-methyl]-4H-1,4-benzothiazin-3-one

Systemtic Name: 2-[[3-tert-butyl-5-(2-methyl-1-oxidanyl-propan-2-yl)-4-oxidanyl-phenyl]-oxidanyl-methyl]-4H-1,4-benzothiazin-3-one Openeye Name: 2-[[3-tert-butyl-4-hydroxy-5-(2-hydroxy-1,1-dimethyl-ethyl)phenyl]-hydroxy-methyl]-4H-1,4-benzothiazin-3-one CAS Name: 2-[[3-tert-butyl-4-hydroxy-5-(1-hydroxy-2-methylpropan-2-yl)phenyl]-hydroxymethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 2-[[3-tert-butyl-4-hydroxy-5-(1-hydroxy-2-methylpropan-2-yl)phenyl]-hydroxymethyl]-4H-1,4-benzothiazin-3-one Traditional Name: 2-[[3-tert-butyl-4-hydroxy-5-(2-hydroxy-1,1-dimethyl-ethyl)phenyl]-hydroxy-methyl]-4H-1,4-benzothiazin-3-one Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)C(C2C(=O)NC3=CC=CC=C3S2)O)C(C)(C)CO)O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)C(C2C(=O)NC3=CC=CC=C3S2)O)C(C)(C)CO)O

InChI

InChI=1S/C23H29NO4S/c1-22(2,3)14-10-13(11-15(19(14)27)23(4,5)12-25)18(26)20-21(28)24-16-8-6-7-9-17(16)29-20/h6-11,18,20,25-27H,12H2,1-5H3,(H,24,28)