3-[[(1S,2S,3R)-3-(2-methoxy-2-oxidanylidene-ethyl)-2-pentyl-cyclopentyl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[(1S,2S,3R)-3-(2-methoxy-2-oxidanylidene-ethyl)-2-pentyl-cyclopentyl]azaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[(1S,2S,3R)-3-(2-methoxy-2-oxo-ethyl)-2-pentyl-cyclopentyl]ammonio]propyl-dimethyl-ammonium CAS Name: 3-[[(1S,2S,3R)-3-(2-methoxy-2-oxoethyl)-2-pentylcyclopentyl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[(1S,2S,3R)-3-(2-methoxy-2-oxoethyl)-2-pentylcyclopentyl]azaniumyl]propyl-dimethylazanium Traditional Name: 3-[[(1S,2S,3R)-2-amyl-3-(2-keto-2-methoxy-ethyl)cyclopentyl]ammonio]propyl-dimethyl-ammonium Formula: C18H38N2O2+2 MolecularWeight: 314.50652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(CCC1[NH2+]CCC[NH+](C)C)CC(=O)OC

Isomeric SMILES

CCCCC[C@H]1[C@H](CC[C@@H]1[NH2+]CCC[NH+](C)C)CC(=O)OC

InChI

InChI=1S/C18H36N2O2/c1-5-6-7-9-16-15(14-18(21)22-4)10-11-17(16)19-12-8-13-20(2)3/h15-17,19H,5-14H2,1-4H3/p+2/t15-,16+,17+/m1/s1