O1-tert-butyl O3-(2-nitrophenyl) 2-azanyl-2-(3-azanyl-3-oxidanylidene-propyl)propanedioate

Systemtic Name: O1-tert-butyl O3-(2-nitrophenyl) 2-azanyl-2-(3-azanyl-3-oxidanylidene-propyl)propanedioate Openeye Name: O1-tert-butyl O3-(2-nitrophenyl) 2-amino-2-(3-amino-3-oxo-propyl)propanedioate CAS Name: 2-amino-2-(3-amino-3-oxopropyl)propanedioic acid O1-tert-butyl ester O3-(2-nitrophenyl) ester IUPAC Name: 1-O-tert-butyl 3-O-(2-nitrophenyl) 2-amino-2-(3-amino-3-oxopropyl)propanedioate Traditional Name: 2-amino-2-(3-amino-3-keto-propyl)malonic acid O1-tert-butyl ester O3-(2-nitrophenyl) ester Formula: C16H21N3O7 MolecularWeight: 367.35384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC(=O)N)(C(=O)OC1=CC=CC=C1[N+](=O)[O-])N

Isomeric SMILES

CC(C)(C)OC(=O)C(CCC(=O)N)(C(=O)OC1=CC=CC=C1[N+](=O)[O-])N

InChI

InChI=1S/C16H21N3O7/c1-15(2,3)26-14(22)16(18,9-8-12(17)20)13(21)25-11-7-5-4-6-10(11)19(23)24/h4-7H,8-9,18H2,1-3H3,(H2,17,20)