[(1R)-1-(3,4-dimethylphenyl)ethyl]-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: [(1R)-1-(3,4-dimethylphenyl)ethyl]-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-[(1R)-1-(3,4-dimethylphenyl)ethyl]ammonium CAS Name: [(1R)-1-(3,4-dimethylphenyl)ethyl]-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: [(1R)-1-(3,4-dimethylphenyl)ethyl]-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-[(1R)-1-(3,4-dimethylphenyl)ethyl]ammonium Formula: C17H30N+ MolecularWeight: 248.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]C(C)CCC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[C@@H](C)[NH2+][C@@H](C)CCC(C)C)C

InChI

InChI=1S/C17H29N/c1-12(2)7-9-15(5)18-16(6)17-10-8-13(3)14(4)11-17/h8,10-12,15-16,18H,7,9H2,1-6H3/p+1/t15-,16+/m0/s1