3-[cyclopentylcarbonyl-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-4-yl]methyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[cyclopentylcarbonyl-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-4-yl]methyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[cyclopentanecarbonyl-[(1-indan-2-ylpiperidin-1-ium-4-yl)methyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[cyclopentyl(oxo)methyl]-[[1-(2,3-dihydro-1H-inden-2-yl)-4-piperidin-1-iumyl]methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[cyclopentanecarbonyl-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-4-yl]methyl]amino]propyl-dimethylazanium Traditional Name: 3-[cyclopentanecarbonyl-[(1-indan-2-ylpiperidin-1-ium-4-yl)methyl]amino]propyl-dimethyl-ammonium Formula: C26H43N3O+2 MolecularWeight: 413.63912

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(CC1CC[NH+](CC1)C2CC3=CC=CC=C3C2)C(=O)C4CCCC4

Isomeric SMILES

C[NH+](C)CCCN(CC1CC[NH+](CC1)C2CC3=CC=CC=C3C2)C(=O)C4CCCC4

InChI

InChI=1S/C26H41N3O/c1-27(2)14-7-15-29(26(30)22-8-3-4-9-22)20-21-12-16-28(17-13-21)25-18-23-10-5-6-11-24(23)19-25/h5-6,10-11,21-22,25H,3-4,7-9,12-20H2,1-2H3/p+2