[2-(methylamino)-2-oxidanylidene-ethyl] 4-[(2-nitrophenyl)amino]butanoate

Systemtic Name: [2-(methylamino)-2-oxidanylidene-ethyl] 4-[(2-nitrophenyl)amino]butanoate Openeye Name: [2-(methylamino)-2-oxo-ethyl] 4-(2-nitroanilino)butanoate CAS Name: 4-(2-nitroanilino)butanoic acid [2-(methylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylamino)-2-oxoethyl] 4-(2-nitroanilino)butanoate Traditional Name: 4-(2-nitroanilino)butyric acid [2-keto-2-(methylamino)ethyl] ester Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)COC(=O)CCCNC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CNC(=O)COC(=O)CCCNC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O5/c1-14-12(17)9-21-13(18)7-4-8-15-10-5-2-3-6-11(10)16(19)20/h2-3,5-6,15H,4,7-9H2,1H3,(H,14,17)