N-[(2R)-3-ethoxy-2-oxidanyl-propyl]-2-piperidin-1-ium-1-yl-1,3-dihydroindene-2-carboxamide

Systemtic Name: N-[(2R)-3-ethoxy-2-oxidanyl-propyl]-2-piperidin-1-ium-1-yl-1,3-dihydroindene-2-carboxamide Openeye Name: N-[(2R)-3-ethoxy-2-hydroxy-propyl]-2-piperidin-1-ium-1-yl-indane-2-carboxamide CAS Name: N-[(2R)-3-ethoxy-2-hydroxypropyl]-2-(1-piperidin-1-iumyl)-1,3-dihydroindene-2-carboxamide IUPAC Name: N-[(2R)-3-ethoxy-2-hydroxypropyl]-2-piperidin-1-ium-1-yl-1,3-dihydroindene-2-carboxamide Traditional Name: N-[(2R)-3-ethoxy-2-hydroxy-propyl]-2-piperidin-1-ium-1-yl-indane-2-carboxamide Formula: C20H31N2O3+ MolecularWeight: 347.47174

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(CNC(=O)C1(CC2=CC=CC=C2C1)[NH+]3CCCCC3)O

Isomeric SMILES

CCOC[C@@H](CNC(=O)C1(CC2=CC=CC=C2C1)[NH+]3CCCCC3)O

InChI

InChI=1S/C20H30N2O3/c1-2-25-15-18(23)14-21-19(24)20(22-10-6-3-7-11-22)12-16-8-4-5-9-17(16)13-20/h4-5,8-9,18,23H,2-3,6-7,10-15H2,1H3,(H,21,24)/p+1/t18-/m1/s1