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

Systemtic Name: 2-azanyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[2-(4-nitrophenyl)ethyl]-3-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-(tert-butoxycarbonylamino)-2-[2-(4-nitrophenyl)ethyl]-3-oxo-pentanoic acid CAS Name: 2-amino-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-[2-(4-nitrophenyl)ethyl]-3-oxopentanoic acid IUPAC Name: 2-amino-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[2-(4-nitrophenyl)ethyl]-3-oxopentanoic acid Traditional Name: 2-amino-5-(tert-butoxycarbonylamino)-3-keto-2-[2-(4-nitrophenyl)ethyl]valeric acid Formula: C18H25N3O7 MolecularWeight: 395.407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)C(CCC1=CC=C(C=C1)[N+](=O)[O-])(C(=O)O)N

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)C(CCC1=CC=C(C=C1)[N+](=O)[O-])(C(=O)O)N

InChI

InChI=1S/C18H25N3O7/c1-17(2,3)28-16(25)20-11-9-14(22)18(19,15(23)24)10-8-12-4-6-13(7-5-12)21(26)27/h4-7H,8-11,19H2,1-3H3,(H,20,25)(H,23,24)