N4-[(3S)-octan-3-yl]pyridine-3,4-diamine

Systemtic Name: N4-[(3S)-octan-3-yl]pyridine-3,4-diamine Openeye Name: N4-[(1S)-1-ethylhexyl]pyridine-3,4-diamine CAS Name: N4-[(3S)-octan-3-yl]pyridine-3,4-diamine IUPAC Name: 4-N-[(3S)-octan-3-yl]pyridine-3,4-diamine Traditional Name: (3-amino-4-pyridyl)-[(1S)-1-ethylhexyl]amine Formula: C13H23N3 MolecularWeight: 221.34182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NC1=C(C=NC=C1)N

Isomeric SMILES

CCCCC[C@H](CC)NC1=C(C=NC=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)/t11-/m0/s1