(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C19H16ClNO4S MolecularWeight: 389.85264

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H16ClNO4S/c20-13-9-12(10-15-19(13)24-8-7-23-15)11-25-18(22)6-5-17-21-14-3-1-2-4-16(14)26-17/h1-4,9-10H,5-8,11H2