2-ethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(3-nitrophenyl)-3-oxidanyl-pentanoic acid

Systemtic Name: 2-ethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(3-nitrophenyl)-3-oxidanyl-pentanoic acid Openeye Name: 4-(tert-butoxycarbonylamino)-2-ethyl-3-hydroxy-5-(3-nitrophenyl)pentanoic acid CAS Name: 2-ethyl-3-hydroxy-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-(3-nitrophenyl)pentanoic acid IUPAC Name: 2-ethyl-3-hydroxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(3-nitrophenyl)pentanoic acid Traditional Name: 4-(tert-butoxycarbonylamino)-2-ethyl-3-hydroxy-5-(3-nitrophenyl)valeric acid Formula: C18H26N2O7 MolecularWeight: 382.40824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O7/c1-5-13(16(22)23)15(21)14(19-17(24)27-18(2,3)4)10-11-7-6-8-12(9-11)20(25)26/h6-9,13-15,21H,5,10H2,1-4H3,(H,19,24)(H,22,23)