ethyl N-butyl-N-(5-nitropyridin-2-yl)carbamate

Systemtic Name: ethyl N-butyl-N-(5-nitropyridin-2-yl)carbamate Openeye Name: ethyl N-butyl-N-(5-nitro-2-pyridyl)carbamate CAS Name: N-butyl-N-(5-nitro-2-pyridinyl)carbamic acid ethyl ester IUPAC Name: ethyl N-butyl-N-(5-nitropyridin-2-yl)carbamate Traditional Name: N-butyl-N-(5-nitro-2-pyridyl)carbamic acid ethyl ester Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC=C(C=C1)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCCCN(C1=NC=C(C=C1)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C12H17N3O4/c1-3-5-8-14(12(16)19-4-2)11-7-6-10(9-13-11)15(17)18/h6-7,9H,3-5,8H2,1-2H3