[(1S)-1-(2,5-dimethylphenyl)-2-(2-oxidanylideneazocan-1-yl)ethyl]azanium

Systemtic Name: [(1S)-1-(2,5-dimethylphenyl)-2-(2-oxidanylideneazocan-1-yl)ethyl]azanium Openeye Name: [(1S)-1-(2,5-dimethylphenyl)-2-(2-oxoazocan-1-yl)ethyl]ammonium CAS Name: [(1S)-1-(2,5-dimethylphenyl)-2-(2-oxo-1-azocanyl)ethyl]ammonium IUPAC Name: [(1S)-1-(2,5-dimethylphenyl)-2-(2-oxoazocan-1-yl)ethyl]azanium Traditional Name: [(1S)-1-(2,5-dimethylphenyl)-2-(2-ketoazocan-1-yl)ethyl]ammonium Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(CN2CCCCCCC2=O)[NH3+]

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@@H](CN2CCCCCCC2=O)[NH3+]

InChI

InChI=1S/C17H26N2O/c1-13-8-9-14(2)15(11-13)16(18)12-19-10-6-4-3-5-7-17(19)20/h8-9,11,16H,3-7,10,12,18H2,1-2H3/p+1/t16-/m1/s1