[(2R)-2-(4-methoxy-2-oxidanyl-phenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(4-methoxy-2-oxidanyl-phenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(2-hydroxy-4-methoxy-phenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(2-hydroxy-4-methoxyphenyl)-2-(4-methyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(2-hydroxy-4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(2-hydroxy-4-methoxy-phenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C14H25N3O2+2 MolecularWeight: 267.3672

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(C[NH3+])C2=C(C=C(C=C2)OC)O

Isomeric SMILES

C[NH+]1CCN(CC1)[C@@H](C[NH3+])C2=C(C=C(C=C2)OC)O

InChI

InChI=1S/C14H23N3O2/c1-16-5-7-17(8-6-16)13(10-15)12-4-3-11(19-2)9-14(12)18/h3-4,9,13,18H,5-8,10,15H2,1-2H3/p+2/t13-/m0/s1