N-[[(3R)-8-(phenylmethyl)-4-oxa-8-azoniaspiro[4.5]decan-3-yl]methyl]quinoline-2-carboxamide

Systemtic Name: N-[[(3R)-8-(phenylmethyl)-4-oxa-8-azoniaspiro[4.5]decan-3-yl]methyl]quinoline-2-carboxamide Openeye Name: N-[[(3R)-8-benzyl-4-oxa-8-azoniaspiro[4.5]decan-3-yl]methyl]quinoline-2-carboxamide CAS Name: N-[[(3R)-8-(phenylmethyl)-4-oxa-8-azoniaspiro[4.5]decan-3-yl]methyl]-2-quinolinecarboxamide IUPAC Name: N-[[(3R)-8-benzyl-4-oxa-8-azoniaspiro[4.5]decan-3-yl]methyl]quinoline-2-carboxamide Traditional Name: N-[[(3R)-8-benzyl-4-oxa-8-azoniaspiro[4.5]decan-3-yl]methyl]quinaldamide Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC[NH+](CC2)CC3=CC=CC=C3)OC1CNC(=O)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CC2(CC[NH+](CC2)CC3=CC=CC=C3)O[C@H]1CNC(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H29N3O2/c30-25(24-11-10-21-8-4-5-9-23(21)28-24)27-18-22-12-13-26(31-22)14-16-29(17-15-26)19-20-6-2-1-3-7-20/h1-11,22H,12-19H2,(H,27,30)/p+1/t22-/m1/s1