[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 5-(2-chlorophenyl)-1,2-oxazole-3-carboxylate

Systemtic Name: [2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 5-(2-chlorophenyl)-1,2-oxazole-3-carboxylate Openeye Name: [2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl] 5-(2-chlorophenyl)isoxazole-3-carboxylate CAS Name: 5-(2-chlorophenyl)-3-isoxazolecarboxylic acid [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 5-(2-chlorophenyl)-1,2-oxazole-3-carboxylate Traditional Name: 5-(2-chlorophenyl)isoxazole-3-carboxylic acid [2-(1,3-benzodioxol-5-yl)-2-keto-ethyl] ester Formula: C19H12ClNO6 MolecularWeight: 385.75468

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)COC(=O)C3=NOC(=C3)C4=CC=CC=C4Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)COC(=O)C3=NOC(=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H12ClNO6/c20-13-4-2-1-3-12(13)17-8-14(21-27-17)19(23)24-9-15(22)11-5-6-16-18(7-11)26-10-25-16/h1-8H,9-10H2