methyl 4-[(3,5-dinitrophenyl)carbonylamino]-3-methyl-benzoate

Systemtic Name: methyl 4-[(3,5-dinitrophenyl)carbonylamino]-3-methyl-benzoate Openeye Name: methyl 4-[(3,5-dinitrobenzoyl)amino]-3-methyl-benzoate CAS Name: 4-[[(3,5-dinitrophenyl)-oxomethyl]amino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[(3,5-dinitrobenzoyl)amino]-3-methylbenzoate Traditional Name: 4-[(3,5-dinitrobenzoyl)amino]-3-methyl-benzoic acid methyl ester Formula: C16H13N3O7 MolecularWeight: 359.29032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O7/c1-9-5-10(16(21)26-2)3-4-14(9)17-15(20)11-6-12(18(22)23)8-13(7-11)19(24)25/h3-8H,1-2H3,(H,17,20)