(4-aminocarbonyl-2-nitro-phenyl)methyl 2-methyl-6-nitro-benzoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 2-methyl-6-nitro-benzoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C16H13N3O7 MolecularWeight: 359.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O7/c1-9-3-2-4-12(18(22)23)14(9)16(21)26-8-11-6-5-10(15(17)20)7-13(11)19(24)25/h2-7H,8H2,1H3,(H2,17,20)