2-[(3S)-3-methylpiperidin-1-yl]-N-[[(2S)-oxolan-2-yl]methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-yl]-N-[[(2S)-oxolan-2-yl]methyl]pyridin-1-ium-3-carboxamide Openeye Name: 2-[(3S)-3-methyl-1-piperidyl]-N-[[(2S)-tetrahydrofuran-2-yl]methyl]pyridin-1-ium-3-carboxamide CAS Name: 2-[(3S)-3-methyl-1-piperidinyl]-N-[[(2S)-2-oxolanyl]methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 2-[(3S)-3-methylpiperidin-1-yl]-N-[[(2S)-oxolan-2-yl]methyl]pyridin-1-ium-3-carboxamide Traditional Name: 2-[(3S)-3-methylpiperidino]-N-[[(2S)-tetrahydrofuran-2-yl]methyl]pyridin-1-ium-3-carboxamide Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=CC=[NH+]2)C(=O)NCC3CCCO3

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=CC=[NH+]2)C(=O)NC[C@@H]3CCCO3

InChI

InChI=1S/C17H25N3O2/c1-13-5-3-9-20(12-13)16-15(7-2-8-18-16)17(21)19-11-14-6-4-10-22-14/h2,7-8,13-14H,3-6,9-12H2,1H3,(H,19,21)/p+1/t13-,14-/m0/s1