N-(1,3-benzodioxol-5-ylmethyl)-3-(5-chloranyl-2,4-dimethoxy-phenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(5-chloranyl-2,4-dimethoxy-phenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(5-chloro-2,4-dimethoxy-phenyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(5-chloro-2,4-dimethoxyphenyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(5-chloro-2,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 3-(5-chloro-2,4-dimethoxy-phenyl)-N-piperonyl-2-isoxazoline-5-carboxamide Formula: C20H19ClN2O6 MolecularWeight: 418.82766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=NOC(C2)C(=O)NCC3=CC4=C(C=C3)OCO4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=NOC(C2)C(=O)NCC3=CC4=C(C=C3)OCO4)Cl)OC

InChI

InChI=1S/C20H19ClN2O6/c1-25-16-8-17(26-2)13(21)6-12(16)14-7-19(29-23-14)20(24)22-9-11-3-4-15-18(5-11)28-10-27-15/h3-6,8,19H,7,9-10H2,1-2H3,(H,22,24)