[(1S)-2-azaniumyl-1-[2,4-bis(oxidanyl)phenyl]ethyl]-cyclohexyl-ethyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-[2,4-bis(oxidanyl)phenyl]ethyl]-cyclohexyl-ethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(2,4-dihydroxyphenyl)ethyl]-cyclohexyl-ethyl-ammonium CAS Name: [(1S)-2-ammonio-1-(2,4-dihydroxyphenyl)ethyl]-cyclohexyl-ethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(2,4-dihydroxyphenyl)ethyl]-cyclohexyl-ethylazanium Traditional Name: [(1S)-2-ammonio-1-(2,4-dihydroxyphenyl)ethyl]-cyclohexyl-ethyl-ammonium Formula: C16H28N2O2+2 MolecularWeight: 280.40572

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](C1CCCCC1)C(C[NH3+])C2=C(C=C(C=C2)O)O

Isomeric SMILES

CC[NH+](C1CCCCC1)[C@H](C[NH3+])C2=C(C=C(C=C2)O)O

InChI

InChI=1S/C16H26N2O2/c1-2-18(12-6-4-3-5-7-12)15(11-17)14-9-8-13(19)10-16(14)20/h8-10,12,15,19-20H,2-7,11,17H2,1H3/p+2/t15-/m1/s1