dimethyl-[2-[(1-methylpiperidin-1-ium-4-yl)methyl-phenethyl-amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: dimethyl-[2-[(1-methylpiperidin-1-ium-4-yl)methyl-phenethyl-amino]-2-oxidanylidene-ethyl]azanium Openeye Name: dimethyl-[2-[(1-methylpiperidin-1-ium-4-yl)methyl-phenethyl-amino]-2-oxo-ethyl]ammonium CAS Name: dimethyl-[2-[(1-methyl-4-piperidin-1-iumyl)methyl-phenethylamino]-2-oxoethyl]ammonium IUPAC Name: dimethyl-[2-[(1-methylpiperidin-1-ium-4-yl)methyl-phenethylamino]-2-oxoethyl]azanium Traditional Name: [2-keto-2-[(1-methylpiperidin-1-ium-4-yl)methyl-phenethyl-amino]ethyl]-dimethyl-ammonium Formula: C19H33N3O+2 MolecularWeight: 319.48482

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)C[NH+](C)C

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)C[NH+](C)C

InChI

InChI=1S/C19H31N3O/c1-20(2)16-19(23)22(14-11-17-7-5-4-6-8-17)15-18-9-12-21(3)13-10-18/h4-8,18H,9-16H2,1-3H3/p+2