1,3-benzothiazol-2-ylmethyl 5-chloranyl-2,3-dihydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 5-chloranyl-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C17H12ClNO4S MolecularWeight: 361.79948

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H12ClNO4S/c18-11-7-10(8-13-16(11)22-6-5-21-13)17(20)23-9-15-19-12-3-1-2-4-14(12)24-15/h1-4,7-8H,5-6,9H2