(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-(1,3-thiazol-4-ylmethoxy)benzoate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-(1,3-thiazol-4-ylmethoxy)benzoate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-(thiazol-4-ylmethoxy)benzoate CAS Name: 4-(4-thiazolylmethoxy)benzoic 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 4-(1,3-thiazol-4-ylmethoxy)benzoate Traditional Name: 4-(thiazol-4-ylmethoxy)benzoic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C20H16ClNO5S MolecularWeight: 417.86274

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=CC=C(C=C3)OCC4=CSC=N4

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=CC=C(C=C3)OCC4=CSC=N4

InChI

InChI=1S/C20H16ClNO5S/c21-17-7-13(8-18-19(17)25-6-5-24-18)9-27-20(23)14-1-3-16(4-2-14)26-10-15-11-28-12-22-15/h1-4,7-8,11-12H,5-6,9-10H2