(2-nitrophenyl)methyl 4-[(2-nitrophenyl)amino]butanoate

Systemtic Name: (2-nitrophenyl)methyl 4-[(2-nitrophenyl)amino]butanoate Openeye Name: (2-nitrophenyl)methyl 4-(2-nitroanilino)butanoate CAS Name: 4-(2-nitroanilino)butanoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 4-(2-nitroanilino)butanoate Traditional Name: 4-(2-nitroanilino)butyric acid (2-nitrobenzyl) ester Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6/c21-17(26-12-13-6-1-3-8-15(13)19(22)23)10-5-11-18-14-7-2-4-9-16(14)20(24)25/h1-4,6-9,18H,5,10-12H2