(3R)-1,1-bis(oxidanylidene)-3-(phenylmethyl)-2H-1,2-benzothiazole-3-carboxylic acid

Systemtic Name: (3R)-1,1-bis(oxidanylidene)-3-(phenylmethyl)-2H-1,2-benzothiazole-3-carboxylic acid Openeye Name: (3R)-3-benzyl-1,1-dioxo-2H-1,2-benzothiazole-3-carboxylic acid CAS Name: (3R)-1,1-dioxo-3-(phenylmethyl)-2H-1,2-benzothiazole-3-carboxylic acid IUPAC Name: (3R)-3-benzyl-1,1-dioxo-2H-1,2-benzothiazole-3-carboxylic acid Traditional Name: (3R)-3-benzyl-1,1-diketo-2H-1,2-benzothiazole-3-carboxylic acid Formula: C15H13NO4S MolecularWeight: 303.33302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2(C3=CC=CC=C3S(=O)(=O)N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@]2(C3=CC=CC=C3S(=O)(=O)N2)C(=O)O

InChI

InChI=1S/C15H13NO4S/c17-14(18)15(10-11-6-2-1-3-7-11)12-8-4-5-9-13(12)21(19,20)16-15/h1-9,16H,10H2,(H,17,18)/t15-/m1/s1