[(2S)-3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanyl-propyl]azanium

Systemtic Name: [(2S)-3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-3-(4-benzhydrylpiperazin-4-ium-1-yl)-2-hydroxy-propyl]ammonium CAS Name: [(2S)-3-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-hydroxypropyl]ammonium IUPAC Name: [(2S)-3-(4-benzhydrylpiperazin-4-ium-1-yl)-2-hydroxypropyl]azanium Traditional Name: [(2S)-3-(4-benzhydrylpiperazin-4-ium-1-yl)-2-hydroxy-propyl]ammonium Formula: C20H29N3O+2 MolecularWeight: 327.46376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)CC(C[NH3+])O

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C[C@H](C[NH3+])O

InChI

InChI=1S/C20H27N3O/c21-15-19(24)16-22-11-13-23(14-12-22)20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,19-20,24H,11-16,21H2/p+2/t19-/m0/s1