1,3-benzothiazol-2-ylmethyl 5-chloranyl-2-methoxy-4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 5-chloranyl-2-methoxy-4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 5-chloro-2-methoxy-4-(tetrazol-1-yl)benzoate CAS Name: 5-chloro-2-methoxy-4-(1-tetrazolyl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 5-chloro-2-methoxy-4-(tetrazol-1-yl)benzoate Traditional Name: 5-chloro-2-methoxy-4-(tetrazol-1-yl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C17H12ClN5O3S MolecularWeight: 401.82688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC2=NC3=CC=CC=C3S2)Cl)N4C=NN=N4

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC2=NC3=CC=CC=C3S2)Cl)N4C=NN=N4

InChI

InChI=1S/C17H12ClN5O3S/c1-25-14-7-13(23-9-19-21-22-23)11(18)6-10(14)17(24)26-8-16-20-12-4-2-3-5-15(12)27-16/h2-7,9H,8H2,1H3