N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-2-(4-oxidanylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-2-(4-oxidanylpiperidin-1-ium-1-yl)ethanamide Openeye Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]acetamide CAS Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidin-1-iumyl]-2-(4-hydroxy-1-piperidin-1-iumyl)acetamide IUPAC Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-2-(4-hydroxypiperidin-1-ium-1-yl)acetamide Traditional Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]acetamide Formula: C21H33N3O2+2 MolecularWeight: 359.50562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CC3=CC=CC=C3C2)NC(=O)C[NH+]4CCC(CC4)O

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CC3=CC=CC=C3C2)NC(=O)C[NH+]4CCC(CC4)O

InChI

InChI=1S/C21H31N3O2/c25-20-7-10-23(11-8-20)15-21(26)22-18-6-3-9-24(14-18)19-12-16-4-1-2-5-17(16)13-19/h1-2,4-5,18-20,25H,3,6-15H2,(H,22,26)/p+2/t18-/m0/s1