ethyl 1-ethyl-4-nitro-5-propyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 1-ethyl-4-nitro-5-propyl-pyrrole-2-carboxylate Openeye Name: ethyl 1-ethyl-4-nitro-5-propyl-pyrrole-2-carboxylate CAS Name: 1-ethyl-4-nitro-5-propyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-4-nitro-5-propylpyrrole-2-carboxylate Traditional Name: 1-ethyl-4-nitro-5-propyl-pyrrole-2-carboxylic acid ethyl ester Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(N1CC)C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C=C(N1CC)C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O4/c1-4-7-9-10(14(16)17)8-11(13(9)5-2)12(15)18-6-3/h8H,4-7H2,1-3H3