N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]pyridin-1-ium-4-amine

Systemtic Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]pyridin-1-ium-4-amine Openeye Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]pyridin-1-ium-4-amine CAS Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-pyridin-1-iumamine IUPAC Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]pyridin-1-ium-4-amine Traditional Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-pyridin-1-ium-4-yl-amine Formula: C13H21N2+ MolecularWeight: 205.31924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC2=CC=[NH+]C=C2

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NC2=CC=[NH+]C=C2

InChI

InChI=1S/C13H20N2/c1-10-4-3-5-13(11(10)2)15-12-6-8-14-9-7-12/h6-11,13H,3-5H2,1-2H3,(H,14,15)/p+1/t10-,11+,13-/m0/s1