(5-methyl-2-nitro-phenyl) 3-nitrobenzoate

Systemtic Name: (5-methyl-2-nitro-phenyl) 3-nitrobenzoate Openeye Name: (5-methyl-2-nitro-phenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (5-methyl-2-nitrophenyl) ester IUPAC Name: (5-methyl-2-nitrophenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (5-methyl-2-nitro-phenyl) ester Formula: C14H10N2O6 MolecularWeight: 302.239

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10N2O6/c1-9-5-6-12(16(20)21)13(7-9)22-14(17)10-3-2-4-11(8-10)15(18)19/h2-8H,1H3