[(1R)-1-(4-cyanophenyl)ethyl]-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: [(1R)-1-(4-cyanophenyl)ethyl]-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: [(1R)-1-(4-cyanophenyl)ethyl]-[(1S)-1,4-dimethylpentyl]ammonium CAS Name: [(1R)-1-(4-cyanophenyl)ethyl]-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: [(1R)-1-(4-cyanophenyl)ethyl]-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: [(1R)-1-(4-cyanophenyl)ethyl]-[(1S)-1,4-dimethylpentyl]ammonium Formula: C16H25N2+ MolecularWeight: 245.3831

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]C(C)C1=CC=C(C=C1)C#N

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+][C@H](C)C1=CC=C(C=C1)C#N

InChI

InChI=1S/C16H24N2/c1-12(2)5-6-13(3)18-14(4)16-9-7-15(11-17)8-10-16/h7-10,12-14,18H,5-6H2,1-4H3/p+1/t13-,14+/m0/s1