methyl 3-[(2,4,6-trinitrophenyl)amino]benzoate

Systemtic Name: methyl 3-[(2,4,6-trinitrophenyl)amino]benzoate Openeye Name: methyl 3-(2,4,6-trinitroanilino)benzoate CAS Name: 3-(2,4,6-trinitroanilino)benzoic acid methyl ester IUPAC Name: methyl 3-(2,4,6-trinitroanilino)benzoate Traditional Name: 3-(2,4,6-trinitroanilino)benzoic acid methyl ester Formula: C14H10N4O8 MolecularWeight: 362.2512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O8/c1-26-14(19)8-3-2-4-9(5-8)15-13-11(17(22)23)6-10(16(20)21)7-12(13)18(24)25/h2-7,15H,1H3