2-[(4-methylphenyl)methyl]-6-oxidanyl-1,3-benzothiazole-5-carboxylic acid

Systemtic Name: 2-[(4-methylphenyl)methyl]-6-oxidanyl-1,3-benzothiazole-5-carboxylic acid Openeye Name: 6-hydroxy-2-(p-tolylmethyl)-1,3-benzothiazole-5-carboxylic acid CAS Name: 6-hydroxy-2-[(4-methylphenyl)methyl]-1,3-benzothiazole-5-carboxylic acid IUPAC Name: 6-hydroxy-2-[(4-methylphenyl)methyl]-1,3-benzothiazole-5-carboxylic acid Traditional Name: 6-hydroxy-2-(4-methylbenzyl)-1,3-benzothiazole-5-carboxylic acid Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NC3=C(S2)C=C(C(=C3)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NC3=C(S2)C=C(C(=C3)C(=O)O)O

InChI

InChI=1S/C16H13NO3S/c1-9-2-4-10(5-3-9)6-15-17-12-7-11(16(19)20)13(18)8-14(12)21-15/h2-5,7-8,18H,6H2,1H3,(H,19,20)