N4-[(3S)-octan-3-yl]pyridin-1-ium-3,4-diamine

Systemtic Name: N4-[(3S)-octan-3-yl]pyridin-1-ium-3,4-diamine Openeye Name: N4-[(1S)-1-ethylhexyl]pyridin-1-ium-3,4-diamine CAS Name: N4-[(3S)-octan-3-yl]pyridin-1-ium-3,4-diamine IUPAC Name: 4-N-[(3S)-octan-3-yl]pyridin-1-ium-3,4-diamine Traditional Name: (3-aminopyridin-1-ium-4-yl)-[(1S)-1-ethylhexyl]amine Formula: C13H24N3+ MolecularWeight: 222.34976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NC1=C(C=[NH+]C=C1)N

Isomeric SMILES

CCCCC[C@H](CC)NC1=C(C=[NH+]C=C1)N

InChI

InChI=1S/C13H23N3/c1-3-5-6-7-11(4-2)16-13-8-9-15-10-12(13)14/h8-11H,3-7,14H2,1-2H3,(H,15,16)/p+1/t11-/m0/s1