[2-(4-azaniumylpiperidin-1-yl)carbonylphenyl]methyl-(2-hydroxyethyl)-methyl-azanium

Systemtic Name: [2-(4-azaniumylpiperidin-1-yl)carbonylphenyl]methyl-(2-hydroxyethyl)-methyl-azanium Openeye Name: [2-(4-azaniumylpiperidine-1-carbonyl)phenyl]methyl-(2-hydroxyethyl)-methyl-ammonium CAS Name: [2-[(4-ammonio-1-piperidinyl)-oxomethyl]phenyl]methyl-(2-hydroxyethyl)-methylammonium IUPAC Name: [2-(4-azaniumylpiperidine-1-carbonyl)phenyl]methyl-(2-hydroxyethyl)-methylazanium Traditional Name: [2-(4-ammoniopiperidine-1-carbonyl)benzyl]-(2-hydroxyethyl)-methyl-ammonium Formula: C16H27N3O2+2 MolecularWeight: 293.40448

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCO)CC1=CC=CC=C1C(=O)N2CCC(CC2)[NH3+]

Isomeric SMILES

C[NH+](CCO)CC1=CC=CC=C1C(=O)N2CCC(CC2)[NH3+]

InChI

InChI=1S/C16H25N3O2/c1-18(10-11-20)12-13-4-2-3-5-15(13)16(21)19-8-6-14(17)7-9-19/h2-5,14,20H,6-12,17H2,1H3/p+2