1,3-benzothiazol-2-ylmethyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(4-chloro-2-keto-1,3-benzothiazol-3-yl)acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C17H11ClN2O3S2 MolecularWeight: 390.86384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)CN3C4=C(C=CC=C4Cl)SC3=O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)CN3C4=C(C=CC=C4Cl)SC3=O

InChI

InChI=1S/C17H11ClN2O3S2/c18-10-4-3-7-13-16(10)20(17(22)25-13)8-15(21)23-9-14-19-11-5-1-2-6-12(11)24-14/h1-7H,8-9H2