[(2R)-2-(2-ethoxyphenyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(2-ethoxyphenyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(2-ethoxyphenyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(2-ethoxyphenyl)-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: [(2R)-2-(2-ethoxyphenyl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium Traditional Name: [(2R)-2-o-phenetyl-2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]ammonium Formula: C19H28N4O+2 MolecularWeight: 328.45182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C[NH3+])N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CCOC1=CC=CC=C1[C@H](C[NH3+])N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C19H26N4O/c1-2-24-18-8-4-3-7-16(18)17(15-20)22-11-13-23(14-12-22)19-9-5-6-10-21-19/h3-10,17H,2,11-15,20H2,1H3/p+2/t17-/m0/s1