O1-methyl O3-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl] ester IUPAC Name: 1-O-methyl 3-O-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] ester O1-methyl ester Formula: C18H18N2O7 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O7/c1-10-5-15(11(2)19(10)3)16(21)9-27-18(23)13-6-12(17(22)26-4)7-14(8-13)20(24)25/h5-8H,9H2,1-4H3