[(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(3-methoxy-2-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(3-methoxy-2-oxidanyl-phenyl)ethyl]azanium Openeye Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(2-hydroxy-3-methoxy-phenyl)ethyl]ammonium CAS Name: [(2S)-2-(4-ethyl-1-piperazin-4-iumyl)-2-(2-hydroxy-3-methoxyphenyl)ethyl]ammonium IUPAC Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(2-hydroxy-3-methoxyphenyl)ethyl]azanium Traditional Name: [(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(2-hydroxy-3-methoxy-phenyl)ethyl]ammonium Formula: C15H27N3O2+2 MolecularWeight: 281.39378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O2/c1-3-17-7-9-18(10-8-17)13(11-16)12-5-4-6-14(20-2)15(12)19/h4-6,13,19H,3,7-11,16H2,1-2H3/p+2/t13-/m1/s1