ethyl 1-[[3-(2-ethoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-1,3-benzoxazol-6-yl]sulfonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[3-(2-ethoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-1,3-benzoxazol-6-yl]sulfonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[[3-(2-ethoxy-2-oxo-ethyl)-2-oxo-1,3-benzoxazol-6-yl]sulfonyl]piperidine-4-carboxylate CAS Name: 1-[[3-(2-ethoxy-2-oxoethyl)-2-oxo-1,3-benzoxazol-6-yl]sulfonyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[3-(2-ethoxy-2-oxoethyl)-2-oxo-1,3-benzoxazol-6-yl]sulfonyl]piperidine-4-carboxylate Traditional Name: 1-[[3-(2-ethoxy-2-keto-ethyl)-2-keto-1,3-benzoxazol-6-yl]sulfonyl]isonipecotic acid ethyl ester Formula: C19H24N2O8S MolecularWeight: 440.46746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)OCC)OC1=O

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)OCC)OC1=O

InChI

InChI=1S/C19H24N2O8S/c1-3-27-17(22)12-21-15-6-5-14(11-16(15)29-19(21)24)30(25,26)20-9-7-13(8-10-20)18(23)28-4-2/h5-6,11,13H,3-4,7-10,12H2,1-2H3