(2-nitrophenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: (2-nitrophenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: (2-nitrophenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid (2-nitrobenzyl) ester Formula: C17H17N3O7 MolecularWeight: 375.33278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O7/c1-26-9-8-18-15-7-6-13(19(22)23)10-14(15)17(21)27-11-12-4-2-3-5-16(12)20(24)25/h2-7,10,18H,8-9,11H2,1H3