[(1S,2S,4S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-cyclohexyl]azanium

Systemtic Name: [(1S,2S,4S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-cyclohexyl]azanium Openeye Name: [(1S,2S,4S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-cyclohexyl]ammonium CAS Name: [(1S,2S,4S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methylcyclohexyl]ammonium IUPAC Name: [(1S,2S,4S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methylcyclohexyl]azanium Traditional Name: [(1S,2S,4S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-cyclohexyl]ammonium Formula: C16H25N2+ MolecularWeight: 245.3831

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)N2CCC3=CC=CC=C3C2)[NH3+]

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)N2CCC3=CC=CC=C3C2)[NH3+]

InChI

InChI=1S/C16H24N2/c1-12-6-7-15(17)16(10-12)18-9-8-13-4-2-3-5-14(13)11-18/h2-5,12,15-16H,6-11,17H2,1H3/p+1/t12-,15-,16-/m0/s1