2-ethoxyethyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(4-nitrophenyl)-3-oxidanyl-pentanoate

Systemtic Name: 2-ethoxyethyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(4-nitrophenyl)-3-oxidanyl-pentanoate Openeye Name: 2-ethoxyethyl 4-(tert-butoxycarbonylamino)-3-hydroxy-5-(4-nitrophenyl)pentanoate CAS Name: 3-hydroxy-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-(4-nitrophenyl)pentanoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 3-hydroxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(4-nitrophenyl)pentanoate Traditional Name: 4-(tert-butoxycarbonylamino)-3-hydroxy-5-(4-nitrophenyl)valeric acid 2-ethoxyethyl ester Formula: C20H30N2O8 MolecularWeight: 426.4608

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)CC(C(CC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OC(C)(C)C)O

Isomeric SMILES

CCOCCOC(=O)CC(C(CC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C20H30N2O8/c1-5-28-10-11-29-18(24)13-17(23)16(21-19(25)30-20(2,3)4)12-14-6-8-15(9-7-14)22(26)27/h6-9,16-17,23H,5,10-13H2,1-4H3,(H,21,25)