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

Systemtic Name: ethyl 4-[3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]-3-pentoxy-1,2-oxazole-5-carboxylate Openeye Name: ethyl 4-[2-(tert-butoxycarbonylamino)-3-ethoxy-3-oxo-propyl]-3-pentoxy-isoxazole-5-carboxylate CAS Name: 4-[3-ethoxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopropyl]-3-pentoxy-5-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]-3-pentoxy-1,2-oxazole-5-carboxylate Traditional Name: 3-amoxy-4-[2-(tert-butoxycarbonylamino)-3-ethoxy-3-keto-propyl]isoxazole-5-carboxylic acid ethyl ester Formula: C21H34N2O8 MolecularWeight: 442.50326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=NOC(=C1CC(C(=O)OCC)NC(=O)OC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCCCCOC1=NOC(=C1CC(C(=O)OCC)NC(=O)OC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C21H34N2O8/c1-7-10-11-12-29-17-14(16(31-23-17)19(25)28-9-3)13-15(18(24)27-8-2)22-20(26)30-21(4,5)6/h15H,7-13H2,1-6H3,(H,22,26)