[(2S)-1-[[(1R,2S)-2-methylcyclohexyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[[(1R,2S)-2-methylcyclohexyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[[(1R,2S)-2-methylcyclohexyl]amino]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[[(1R,2S)-2-methylcyclohexyl]amino]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-keto-2-[[(1R,2S)-2-methylcyclohexyl]amino]ethyl]ammonium Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)[C@H](CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C16H24N2O/c1-12-7-5-6-10-15(12)18-16(19)14(17)11-13-8-3-2-4-9-13/h2-4,8-9,12,14-15H,5-7,10-11,17H2,1H3,(H,18,19)/p+1/t12-,14-,15+/m0/s1