[5-[[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]carbamoyl]furan-2-yl]methyl-dimethyl-azanium

Systemtic Name: [5-[[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]carbamoyl]furan-2-yl]methyl-dimethyl-azanium Openeye Name: [5-[[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]carbamoyl]-2-furyl]methyl-dimethyl-ammonium CAS Name: [5-[[[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidin-1-iumyl]amino]-oxomethyl]-2-furanyl]methyl-dimethylammonium IUPAC Name: [5-[[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]carbamoyl]furan-2-yl]methyl-dimethylazanium Traditional Name: [5-[[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]carbamoyl]-2-furyl]methyl-dimethyl-ammonium Formula: C22H31N3O2+2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(O1)C(=O)NC2CCC[NH+](C2)C3CC4=CC=CC=C4C3

Isomeric SMILES

C[NH+](C)CC1=CC=C(O1)C(=O)N[C@H]2CCC[NH+](C2)C3CC4=CC=CC=C4C3

InChI

InChI=1S/C22H29N3O2/c1-24(2)15-20-9-10-21(27-20)22(26)23-18-8-5-11-25(14-18)19-12-16-6-3-4-7-17(16)13-19/h3-4,6-7,9-10,18-19H,5,8,11-15H2,1-2H3,(H,23,26)/p+2/t18-/m0/s1