[(2S)-2-(2-ethoxyphenyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(2-ethoxyphenyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(2S)-2-(2-ethoxyphenyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(2S)-2-(2-ethoxyphenyl)-2-(4-propyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(2S)-2-(2-ethoxyphenyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(2S)-2-o-phenetyl-2-(4-propylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C17H31N3O+2 MolecularWeight: 293.44754

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(C[NH3+])C2=CC=CC=C2OCC

Isomeric SMILES

CCC[NH+]1CCN(CC1)[C@H](C[NH3+])C2=CC=CC=C2OCC

InChI

InChI=1S/C17H29N3O/c1-3-9-19-10-12-20(13-11-19)16(14-18)15-7-5-6-8-17(15)21-4-2/h5-8,16H,3-4,9-14,18H2,1-2H3/p+2/t16-/m1/s1