1,3-benzodioxol-5-ylmethyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: 1,3-benzodioxol-5-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-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-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 piperonyl ester Formula: C17H12ClNO5S MolecularWeight: 377.79888

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC(=O)CN3C4=C(C=CC=C4Cl)SC3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC(=O)CN3C4=C(C=CC=C4Cl)SC3=O

InChI

InChI=1S/C17H12ClNO5S/c18-11-2-1-3-14-16(11)19(17(21)25-14)7-15(20)22-8-10-4-5-12-13(6-10)24-9-23-12/h1-6H,7-9H2