methyl 3-nitro-4-[(2-nitrophenyl)methylamino]benzoate

Systemtic Name: methyl 3-nitro-4-[(2-nitrophenyl)methylamino]benzoate Openeye Name: methyl 3-nitro-4-[(2-nitrophenyl)methylamino]benzoate CAS Name: 3-nitro-4-[(2-nitrophenyl)methylamino]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-4-[(2-nitrophenyl)methylamino]benzoate Traditional Name: 3-nitro-4-[(2-nitrobenzyl)amino]benzoic acid methyl ester Formula: C15H13N3O6 MolecularWeight: 331.28022

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O6/c1-24-15(19)10-6-7-12(14(8-10)18(22)23)16-9-11-4-2-3-5-13(11)17(20)21/h2-8,16H,9H2,1H3