O2-ethyl O4-[(3-nitrophenyl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-[(3-nitrophenyl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-ethyl O4-[(3-nitrophenyl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-[(3-nitrophenyl)methyl] ester IUPAC Name: 2-O-ethyl 4-O-[(3-nitrophenyl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-(3-nitrobenzyl) ester Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H18N2O6/c1-4-24-17(21)15-10(2)14(11(3)18-15)16(20)25-9-12-6-5-7-13(8-12)19(22)23/h5-8,18H,4,9H2,1-3H3