methyl 5-chloranyl-4-[(3,5-dinitrophenyl)carbonylamino]-2-methoxy-benzoate

Systemtic Name: methyl 5-chloranyl-4-[(3,5-dinitrophenyl)carbonylamino]-2-methoxy-benzoate Openeye Name: methyl 5-chloro-4-[(3,5-dinitrobenzoyl)amino]-2-methoxy-benzoate CAS Name: 5-chloro-4-[[(3,5-dinitrophenyl)-oxomethyl]amino]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-chloro-4-[(3,5-dinitrobenzoyl)amino]-2-methoxybenzoate Traditional Name: 5-chloro-4-[(3,5-dinitrobenzoyl)amino]-2-methoxy-benzoic acid methyl ester Formula: C16H12ClN3O8 MolecularWeight: 409.73478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OC)Cl)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OC)Cl)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN3O8/c1-27-14-7-13(12(17)6-11(14)16(22)28-2)18-15(21)8-3-9(19(23)24)5-10(4-8)20(25)26/h3-7H,1-2H3,(H,18,21)