methyl 2-[5-(3,5-dinitrophenyl)carbonyl-1-methyl-pyrrol-2-yl]ethanoate

Systemtic Name: methyl 2-[5-(3,5-dinitrophenyl)carbonyl-1-methyl-pyrrol-2-yl]ethanoate Openeye Name: methyl 2-[5-(3,5-dinitrobenzoyl)-1-methyl-pyrrol-2-yl]acetate CAS Name: 2-[5-[(3,5-dinitrophenyl)-oxomethyl]-1-methyl-2-pyrrolyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-(3,5-dinitrobenzoyl)-1-methylpyrrol-2-yl]acetate Traditional Name: 2-[5-(3,5-dinitrobenzoyl)-1-methyl-pyrrol-2-yl]acetic acid methyl ester Formula: C15H13N3O7 MolecularWeight: 347.27962

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])CC(=O)OC

Isomeric SMILES

CN1C(=CC=C1C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])CC(=O)OC

InChI

InChI=1S/C15H13N3O7/c1-16-10(8-14(19)25-2)3-4-13(16)15(20)9-5-11(17(21)22)7-12(6-9)18(23)24/h3-7H,8H2,1-2H3