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

Systemtic Name: 3-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-4-yl]methyl-(4-methoxy-4-oxidanylidene-butanoyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(1-indan-2-ylpiperidin-1-ium-4-yl)methyl-(4-methoxy-4-oxo-butanoyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[1-(2,3-dihydro-1H-inden-2-yl)-4-piperidin-1-iumyl]methyl-(4-methoxy-1,4-dioxobutyl)amino]propyl-dimethylammonium IUPAC Name: 3-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-4-yl]methyl-(4-methoxy-4-oxobutanoyl)amino]propyl-dimethylazanium Traditional Name: 3-[(1-indan-2-ylpiperidin-1-ium-4-yl)methyl-(4-keto-4-methoxy-butanoyl)amino]propyl-dimethyl-ammonium Formula: C25H41N3O3+2 MolecularWeight: 431.61134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H39N3O3/c1-26(2)13-6-14-28(24(29)9-10-25(30)31-3)19-20-11-15-27(16-12-20)23-17-21-7-4-5-8-22(21)18-23/h4-5,7-8,20,23H,6,9-19H2,1-3H3/p+2