methyl 1-(3,5-dinitrophenyl)carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(3,5-dinitrophenyl)carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(3,5-dinitrobenzoyl)pyrrolidine-2-carboxylate CAS Name: 1-[(3,5-dinitrophenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3,5-dinitrobenzoyl)pyrrolidine-2-carboxylate Traditional Name: 1-(3,5-dinitrobenzoyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C13H13N3O7 MolecularWeight: 323.25822

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CCCN1C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O7/c1-23-13(18)11-3-2-4-14(11)12(17)8-5-9(15(19)20)7-10(6-8)16(21)22/h5-7,11H,2-4H2,1H3