tert-butyl N-[2-(butylamino)-5-nitro-pyridin-4-yl]carbamate

Systemtic Name: tert-butyl N-[2-(butylamino)-5-nitro-pyridin-4-yl]carbamate Openeye Name: tert-butyl N-[2-(butylamino)-5-nitro-4-pyridyl]carbamate CAS Name: N-[2-(butylamino)-5-nitro-4-pyridinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(butylamino)-5-nitropyridin-4-yl]carbamate Traditional Name: N-[2-(butylamino)-5-nitro-4-pyridyl]carbamic acid tert-butyl ester Formula: C14H22N4O4 MolecularWeight: 310.34888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=C(C(=C1)NC(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=NC=C(C(=C1)NC(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H22N4O4/c1-5-6-7-15-12-8-10(11(9-16-12)18(20)21)17-13(19)22-14(2,3)4/h8-9H,5-7H2,1-4H3,(H2,15,16,17,19)