(3-methoxycarbonylphenyl)methyl 1,3-benzothiazole-6-carboxylate

Systemtic Name: (3-methoxycarbonylphenyl)methyl 1,3-benzothiazole-6-carboxylate Openeye Name: (3-methoxycarbonylphenyl)methyl 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid (3-carbomethoxybenzyl) ester Formula: C17H13NO4S MolecularWeight: 327.35442

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C17H13NO4S/c1-21-16(19)12-4-2-3-11(7-12)9-22-17(20)13-5-6-14-15(8-13)23-10-18-14/h2-8,10H,9H2,1H3