[(2R)-2-oxidanyl-2-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]ethyl]azanium

Systemtic Name: [(2R)-2-oxidanyl-2-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]ethyl]azanium Openeye Name: [(2R)-2-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-hydroxy-ethyl]ammonium CAS Name: [(2R)-2-hydroxy-2-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]ethyl]ammonium IUPAC Name: [(2R)-2-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-hydroxyethyl]azanium Traditional Name: [(2R)-2-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-hydroxy-ethyl]ammonium Formula: C19H27N3O+2 MolecularWeight: 313.43718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)C(C[NH3+])O

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)[C@H](C[NH3+])O

InChI

InChI=1S/C19H25N3O/c20-14-19(23)17-6-8-18(9-7-17)22-12-10-21(11-13-22)15-16-4-2-1-3-5-16/h1-9,19,23H,10-15,20H2/p+2/t19-/m0/s1