N-[(1S)-1-(1-adamantyl)ethyl]pyridin-1-ium-2-amine

Systemtic Name: N-[(1S)-1-(1-adamantyl)ethyl]pyridin-1-ium-2-amine Openeye Name: N-[(1S)-1-(1-adamantyl)ethyl]pyridin-1-ium-2-amine CAS Name: N-[(1S)-1-(1-adamantyl)ethyl]-2-pyridin-1-iumamine IUPAC Name: N-[(1S)-1-(1-adamantyl)ethyl]pyridin-1-ium-2-amine Traditional Name: [(1S)-1-(1-adamantyl)ethyl]-pyridin-1-ium-2-yl-amine Formula: C17H25N2+ MolecularWeight: 257.3938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC4=CC=CC=[NH+]4

Isomeric SMILES

C[C@@H](C12CC3CC(C1)CC(C3)C2)NC4=CC=CC=[NH+]4

InChI

InChI=1S/C17H24N2/c1-12(19-16-4-2-3-5-18-16)17-9-13-6-14(10-17)8-15(7-13)11-17/h2-5,12-15H,6-11H2,1H3,(H,18,19)/p+1/t12-,13?,14?,15?,17?/m0/s1