N-butylpyridin-2-amine; 1-[nitro(sulfino)amino]butane

Systemtic Name: N-butylpyridin-2-amine; 1-[nitro(sulfino)amino]butane Openeye Name: N-butylpyridin-2-amine; 1-[nitro(sulfino)amino]butane CAS Name: N-butyl-2-pyridinamine; 1-[nitro(sulfino)amino]butane IUPAC Name: N-butylpyridin-2-amine; 1-[nitro(sulfino)amino]butane Traditional Name: butyl(2-pyridyl)amine; 1-[nitro(sulfino)amino]butane Formula: C13H24N4O4S MolecularWeight: 332.41906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=CC=N1.CCCCN([N+](=O)[O-])S(=O)O

Isomeric SMILES

CCCCNC1=CC=CC=N1.CCCCN([N+](=O)[O-])S(=O)O

InChI

InChI=1S/C9H14N2.C4H10N2O4S/c1-2-3-7-10-9-6-4-5-8-11-9;1-2-3-4-5(6(7)8)11(9)10/h4-6,8H,2-3,7H2,1H3,(H,10,11);2-4H2,1H3,(H,9,10)