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

Systemtic Name: ethyl 5-ethyl-1-hexyl-4-nitro-pyrrole-2-carboxylate Openeye Name: ethyl 5-ethyl-1-hexyl-4-nitro-pyrrole-2-carboxylate CAS Name: 5-ethyl-1-hexyl-4-nitro-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-1-hexyl-4-nitropyrrole-2-carboxylate Traditional Name: 5-ethyl-1-hexyl-4-nitro-pyrrole-2-carboxylic acid ethyl ester Formula: C15H24N2O4 MolecularWeight: 296.36206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=CC(=C1CC)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCCCCCN1C(=CC(=C1CC)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C15H24N2O4/c1-4-7-8-9-10-16-12(5-2)13(17(19)20)11-14(16)15(18)21-6-3/h11H,4-10H2,1-3H3