(phenylmethyl) 3-ethoxy-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]oxy-3-oxidanylidene-propyl]-1,2-oxazole-5-carboxylate

Systemtic Name: (phenylmethyl) 3-ethoxy-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]oxy-3-oxidanylidene-propyl]-1,2-oxazole-5-carboxylate Openeye Name: benzyl 4-[3-(tert-butoxycarbonylamino)oxy-3-oxo-propyl]-3-ethoxy-isoxazole-5-carboxylate CAS Name: 3-ethoxy-4-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]oxy-3-oxopropyl]-5-isoxazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-ethoxy-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]oxy-3-oxopropyl]-1,2-oxazole-5-carboxylate Traditional Name: 4-[3-(tert-butoxycarbonylamino)oxy-3-keto-propyl]-3-ethoxy-isoxazole-5-carboxylic acid benzyl ester Formula: C21H26N2O8 MolecularWeight: 434.43974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NOC(=C1CCC(=O)ONC(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC1=NOC(=C1CCC(=O)ONC(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O8/c1-5-27-18-15(11-12-16(24)30-23-20(26)29-21(2,3)4)17(31-22-18)19(25)28-13-14-9-7-6-8-10-14/h6-10H,5,11-13H2,1-4H3,(H,23,26)