methyl 4-[(4-methoxyphenyl)amino]-3,5-dinitro-benzoate

Systemtic Name: methyl 4-[(4-methoxyphenyl)amino]-3,5-dinitro-benzoate Openeye Name: methyl 4-(4-methoxyanilino)-3,5-dinitro-benzoate CAS Name: 4-(4-methoxyanilino)-3,5-dinitrobenzoic acid methyl ester IUPAC Name: methyl 4-(4-methoxyanilino)-3,5-dinitrobenzoate Traditional Name: 3,5-dinitro-4-(p-anisidino)benzoic acid methyl ester Formula: C15H13N3O7 MolecularWeight: 347.27962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O7/c1-24-11-5-3-10(4-6-11)16-14-12(17(20)21)7-9(15(19)25-2)8-13(14)18(22)23/h3-8,16H,1-2H3