3-oxidanyl-1,1-bis(oxidanylidene)-2-(2-phenylpropan-2-yl)-3H-1,2-benzothiazole-7-carbaldehyde

Systemtic Name: 3-oxidanyl-1,1-bis(oxidanylidene)-2-(2-phenylpropan-2-yl)-3H-1,2-benzothiazole-7-carbaldehyde Openeye Name: 3-hydroxy-2-(1-methyl-1-phenyl-ethyl)-1,1-dioxo-3H-1,2-benzothiazole-7-carbaldehyde CAS Name: 3-hydroxy-1,1-dioxo-2-(2-phenylpropan-2-yl)-3H-1,2-benzothiazole-7-carboxaldehyde IUPAC Name: 3-hydroxy-1,1-dioxo-2-(2-phenylpropan-2-yl)-3H-1,2-benzothiazole-7-carbaldehyde Traditional Name: 2-cumyl-3-hydroxy-1,1-diketo-3H-1,2-benzothiazole-7-carbaldehyde Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)N2C(C3=CC=CC(=C3S2(=O)=O)C=O)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)N2C(C3=CC=CC(=C3S2(=O)=O)C=O)O

InChI

InChI=1S/C17H17NO4S/c1-17(2,13-8-4-3-5-9-13)18-16(20)14-10-6-7-12(11-19)15(14)23(18,21)22/h3-11,16,20H,1-2H3