methyl 2-(3,5-ditert-butylphenyl)-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-(3,5-ditert-butylphenyl)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(3,5-ditert-butylphenyl)-1,3-benzothiazole-6-carboxylate CAS Name: 2-(3,5-ditert-butylphenyl)-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(3,5-ditert-butylphenyl)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(3,5-ditert-butylphenyl)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C23H27NO2S MolecularWeight: 381.53098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)OC)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)OC)C(C)(C)C

InChI

InChI=1S/C23H27NO2S/c1-22(2,3)16-10-15(11-17(13-16)23(4,5)6)20-24-18-9-8-14(21(25)26-7)12-19(18)27-20/h8-13H,1-7H3