methyl 4-[(4-chloranyl-1,3-benzothiazol-7-yl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(4-chloranyl-1,3-benzothiazol-7-yl)carbamoyl]benzoate Openeye Name: methyl 4-[(4-chloro-1,3-benzothiazol-7-yl)carbamoyl]benzoate CAS Name: 4-[[(4-chloro-1,3-benzothiazol-7-yl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-chloro-1,3-benzothiazol-7-yl)carbamoyl]benzoate Traditional Name: 4-[(4-chloro-1,3-benzothiazol-7-yl)carbamoyl]benzoic acid methyl ester Formula: C16H11ClN2O3S MolecularWeight: 346.78814

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)Cl)N=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)Cl)N=CS3

InChI

InChI=1S/C16H11ClN2O3S/c1-22-16(21)10-4-2-9(3-5-10)15(20)19-12-7-6-11(17)13-14(12)23-8-18-13/h2-8H,1H3,(H,19,20)