5-methyl-4-nitro-1,2-benzothiazole-3-carboxylic acid

Systemtic Name: 5-methyl-4-nitro-1,2-benzothiazole-3-carboxylic acid Openeye Name: 5-methyl-4-nitro-1,2-benzothiazole-3-carboxylic acid CAS Name: 5-methyl-4-nitro-1,2-benzothiazole-3-carboxylic acid IUPAC Name: 5-methyl-4-nitro-1,2-benzothiazole-3-carboxylic acid Traditional Name: 5-methyl-4-nitro-1,2-benzothiazole-3-carboxylic acid Formula: C9H6N2O4S MolecularWeight: 238.21994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SN=C2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(C=C1)SN=C2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H6N2O4S/c1-4-2-3-5-6(8(4)11(14)15)7(9(12)13)10-16-5/h2-3H,1H3,(H,12,13)