ethyl 5-nitro-2-propyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-nitro-2-propyl-pyridine-3-carboxylate Openeye Name: ethyl 5-nitro-2-propyl-pyridine-3-carboxylate CAS Name: 5-nitro-2-propyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-nitro-2-propylpyridine-3-carboxylate Traditional Name: 5-nitro-2-propyl-nicotinic acid ethyl ester Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C(C=C1C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NC=C(C=C1C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O4/c1-3-5-10-9(11(14)17-4-2)6-8(7-12-10)13(15)16/h6-7H,3-5H2,1-2H3