methyl 5-(2-ethoxy-2-oxidanylidene-ethanoyl)-1-methyl-2-(2-nitrophenyl)carbonyl-pyrrole-3-carboxylate

Systemtic Name: methyl 5-(2-ethoxy-2-oxidanylidene-ethanoyl)-1-methyl-2-(2-nitrophenyl)carbonyl-pyrrole-3-carboxylate Openeye Name: methyl 5-(2-ethoxy-2-oxo-acetyl)-1-methyl-2-(2-nitrobenzoyl)pyrrole-3-carboxylate CAS Name: 5-(2-ethoxy-1,2-dioxoethyl)-1-methyl-2-[(2-nitrophenyl)-oxomethyl]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 5-(2-ethoxy-2-oxoacetyl)-1-methyl-2-(2-nitrobenzoyl)pyrrole-3-carboxylate Traditional Name: 5-ethoxalyl-1-methyl-2-(2-nitrobenzoyl)pyrrole-3-carboxylic acid methyl ester Formula: C18H16N2O8 MolecularWeight: 388.32824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=CC(=C(N1C)C(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCOC(=O)C(=O)C1=CC(=C(N1C)C(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H16N2O8/c1-4-28-18(24)16(22)13-9-11(17(23)27-3)14(19(13)2)15(21)10-7-5-6-8-12(10)20(25)26/h5-9H,4H2,1-3H3