N-[2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]ethyl]-1-benzofuran-5-carboxamide

Systemtic Name: N-[2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]ethyl]-1-benzofuran-5-carboxamide Openeye Name: N-[2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]ethyl]benzofuran-5-carboxamide CAS Name: N-[2-[(3S)-3-hydroxy-1-piperidin-1-iumyl]ethyl]-5-benzofurancarboxamide IUPAC Name: N-[2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]ethyl]-1-benzofuran-5-carboxamide Traditional Name: N-[2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]ethyl]benzofuran-5-carboxamide Formula: C16H21N2O3+ MolecularWeight: 289.34954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCNC(=O)C2=CC3=C(C=C2)OC=C3)O

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCNC(=O)C2=CC3=C(C=C2)OC=C3)O

InChI

InChI=1S/C16H20N2O3/c19-14-2-1-7-18(11-14)8-6-17-16(20)13-3-4-15-12(10-13)5-9-21-15/h3-5,9-10,14,19H,1-2,6-8,11H2,(H,17,20)/p+1/t14-/m0/s1