[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] 3-chloranyl-5-ethoxy-4-propoxy-benzoate

Systemtic Name: [2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] 3-chloranyl-5-ethoxy-4-propoxy-benzoate Openeye Name: [2-(isoxazol-3-ylamino)-2-oxo-ethyl] 3-chloro-5-ethoxy-4-propoxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-propoxybenzoic acid [2-(3-isoxazolylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,2-oxazol-3-ylamino)-2-oxoethyl] 3-chloro-5-ethoxy-4-propoxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-propoxy-benzoic acid [2-(isoxazol-3-ylamino)-2-keto-ethyl] ester Formula: C17H19ClN2O6 MolecularWeight: 382.79556

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC2=NOC=C2)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC2=NOC=C2)OCC

InChI

InChI=1S/C17H19ClN2O6/c1-3-6-24-16-12(18)8-11(9-13(16)23-4-2)17(22)25-10-15(21)19-14-5-7-26-20-14/h5,7-9H,3-4,6,10H2,1-2H3,(H,19,20,21)