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

Systemtic Name: [(1S)-1-[2,4-bis(oxidanyl)phenyl]ethyl]-cycloheptyl-azanium Openeye Name: cycloheptyl-[(1S)-1-(2,4-dihydroxyphenyl)ethyl]ammonium CAS Name: cycloheptyl-[(1S)-1-(2,4-dihydroxyphenyl)ethyl]ammonium IUPAC Name: cycloheptyl-[(1S)-1-(2,4-dihydroxyphenyl)ethyl]azanium Traditional Name: cycloheptyl-[(1S)-1-(2,4-dihydroxyphenyl)ethyl]ammonium Formula: C15H24NO2+ MolecularWeight: 250.35656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)O)O)[NH2+]C2CCCCCC2

Isomeric SMILES

C[C@@H](C1=C(C=C(C=C1)O)O)[NH2+]C2CCCCCC2

InChI

InChI=1S/C15H23NO2/c1-11(14-9-8-13(17)10-15(14)18)16-12-6-4-2-3-5-7-12/h8-12,16-18H,2-7H2,1H3/p+1/t11-/m0/s1