(1,4-dimethyl-1-phenethyl-piperidin-1-ium-4-yl)-methyl-phenyl-propanoyl-azanium

Systemtic Name: (1,4-dimethyl-1-phenethyl-piperidin-1-ium-4-yl)-methyl-phenyl-propanoyl-azanium Openeye Name: (1,4-dimethyl-1-phenethyl-piperidin-1-ium-4-yl)-methyl-phenyl-propanoyl-ammonium CAS Name: (1,4-dimethyl-1-phenethyl-4-piperidin-1-iumyl)-methyl-(1-oxopropyl)-phenylammonium IUPAC Name: (1,4-dimethyl-1-phenethylpiperidin-1-ium-4-yl)-methyl-phenyl-propanoylazanium Traditional Name: (1,4-dimethyl-1-phenethyl-piperidin-1-ium-4-yl)-methyl-phenyl-propionyl-ammonium Formula: C25H36N2O+2 MolecularWeight: 380.56614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)[N+](C)(C1=CC=CC=C1)C2(CC[N+](CC2)(C)CCC3=CC=CC=C3)C

Isomeric SMILES

CCC(=O)[N+](C)(C1=CC=CC=C1)C2(CC[N+](CC2)(C)CCC3=CC=CC=C3)C

InChI

InChI=1S/C25H36N2O/c1-5-24(28)27(4,23-14-10-7-11-15-23)25(2)17-20-26(3,21-18-25)19-16-22-12-8-6-9-13-22/h6-15H,5,16-21H2,1-4H3/q+2