[1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-chloranyl-5-ethoxy-4-propoxy-benzoate

Systemtic Name: [1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-chloranyl-5-ethoxy-4-propoxy-benzoate Openeye Name: [2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl] 3-chloro-5-ethoxy-4-propoxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-propoxybenzoic acid [1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 3-chloro-5-ethoxy-4-propoxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-propoxy-benzoic acid [2-(2-furfurylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H24ClNO6 MolecularWeight: 409.86066

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)OC(C)C(=O)NCC2=CC=CO2)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)OC(C)C(=O)NCC2=CC=CO2)OCC

InChI

InChI=1S/C20H24ClNO6/c1-4-8-27-18-16(21)10-14(11-17(18)25-5-2)20(24)28-13(3)19(23)22-12-15-7-6-9-26-15/h6-7,9-11,13H,4-5,8,12H2,1-3H3,(H,22,23)