2-[(3R)-3-carboxypiperidin-1-ium-1-yl]ethyl-(3,3-diphenylpropyl)-methyl-azanium dichloride

Systemtic Name: 2-[(3R)-3-carboxypiperidin-1-ium-1-yl]ethyl-(3,3-diphenylpropyl)-methyl-azanium dichloride Openeye Name: 2-[(3R)-3-carboxypiperidin-1-ium-1-yl]ethyl-(3,3-diphenylpropyl)-methyl-ammonium dichloride CAS Name: 2-[(3R)-3-carboxy-1-piperidin-1-iumyl]ethyl-(3,3-diphenylpropyl)-methylammonium dichloride IUPAC Name: 2-[(3R)-3-carboxypiperidin-1-ium-1-yl]ethyl-(3,3-diphenylpropyl)-methylazanium dichloride Traditional Name: 2-[(3R)-3-carboxypiperidin-1-ium-1-yl]ethyl-(3,3-diphenylpropyl)-methyl-ammonium dichloride Formula: C24H34Cl2N2O2 MolecularWeight: 453.44496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(C1=CC=CC=C1)C2=CC=CC=C2)CC[NH+]3CCCC(C3)C(=O)O.[Cl-].[Cl-]

Isomeric SMILES

C[NH+](CCC(C1=CC=CC=C1)C2=CC=CC=C2)CC[NH+]3CCC[C@H](C3)C(=O)O.[Cl-].[Cl-]

InChI

InChI=1S/C24H32N2O2.2ClH/c1-25(17-18-26-15-8-13-22(19-26)24(27)28)16-14-23(20-9-4-2-5-10-20)21-11-6-3-7-12-21;;/h2-7,9-12,22-23H,8,13-19H2,1H3,(H,27,28);2*1H/t22-;;/m1../s1