N4-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]benzene-1,4-diamine

Systemtic Name: N4-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]benzene-1,4-diamine Openeye Name: N4-[(3R)-quinuclidin-1-ium-3-yl]benzene-1,4-diamine CAS Name: N4-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]benzene-1,4-diamine IUPAC Name: 4-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]benzene-1,4-diamine Traditional Name: (4-aminophenyl)-[(3R)-quinuclidin-1-ium-3-yl]amine Formula: C13H20N3+ MolecularWeight: 218.318

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)NC3=CC=C(C=C3)N

Isomeric SMILES

C1C[NH+]2CCC1[C@H](C2)NC3=CC=C(C=C3)N

InChI

InChI=1S/C13H19N3/c14-11-1-3-12(4-2-11)15-13-9-16-7-5-10(13)6-8-16/h1-4,10,13,15H,5-9,14H2/p+1/t13-/m0/s1