tert-butyl N-[3-(4-nitrophenyl)-1-oxidanylidene-1-(2-oxidanylidenepropylamino)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-(4-nitrophenyl)-1-oxidanylidene-1-(2-oxidanylidenepropylamino)propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-(acetonylamino)-1-[(4-nitrophenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[3-(4-nitrophenyl)-1-oxo-1-(2-oxopropylamino)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(4-nitrophenyl)-1-oxo-1-(2-oxopropylamino)propan-2-yl]carbamate Traditional Name: N-[2-(acetonylamino)-2-keto-1-(4-nitrobenzyl)ethyl]carbamic acid tert-butyl ester Formula: C17H23N3O6 MolecularWeight: 365.38102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O6/c1-11(21)10-18-15(22)14(19-16(23)26-17(2,3)4)9-12-5-7-13(8-6-12)20(24)25/h5-8,14H,9-10H2,1-4H3,(H,18,22)(H,19,23)