3-[2-[(2S)-2-(2-pyridin-1-ium-2-ylethyl)piperidin-1-ium-1-yl]ethyl]pyridine

Systemtic Name: 3-[2-[(2S)-2-(2-pyridin-1-ium-2-ylethyl)piperidin-1-ium-1-yl]ethyl]pyridine Openeye Name: 3-[2-[(2S)-2-(2-pyridin-1-ium-2-ylethyl)piperidin-1-ium-1-yl]ethyl]pyridine CAS Name: 3-[2-[(2S)-2-[2-(2-pyridin-1-iumyl)ethyl]-1-piperidin-1-iumyl]ethyl]pyridine IUPAC Name: 3-[2-[(2S)-2-(2-pyridin-1-ium-2-ylethyl)piperidin-1-ium-1-yl]ethyl]pyridine Traditional Name: 3-[2-[(2S)-2-(2-pyridin-1-ium-2-ylethyl)piperidin-1-ium-1-yl]ethyl]pyridine Formula: C19H27N3+2 MolecularWeight: 297.43778

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)CCC2=CC=CC=[NH+]2)CCC3=CN=CC=C3

Isomeric SMILES

C1CC[NH+]([C@@H](C1)CCC2=CC=CC=[NH+]2)CCC3=CN=CC=C3

InChI

InChI=1S/C19H25N3/c1-3-13-21-18(7-1)9-10-19-8-2-4-14-22(19)15-11-17-6-5-12-20-16-17/h1,3,5-7,12-13,16,19H,2,4,8-11,14-15H2/p+2/t19-/m0/s1