[(2R)-2-(3-hydroxyphenyl)-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(3-hydroxyphenyl)-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(4-benzylpiperazin-4-ium-1-yl)-2-(3-hydroxyphenyl)ethyl]ammonium CAS Name: [(2R)-2-(3-hydroxyphenyl)-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(4-benzylpiperazin-4-ium-1-yl)-2-(3-hydroxyphenyl)ethyl]azanium Traditional Name: [(2R)-2-(4-benzylpiperazin-4-ium-1-yl)-2-(3-hydroxyphenyl)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)C(C[NH3+])C3=CC(=CC=C3)O

Isomeric SMILES

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

InChI

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