[1-(3,5-dimethylphenyl)piperidin-4-yl]-[(2S)-3-methylbutan-2-yl]azanium

Systemtic Name: [1-(3,5-dimethylphenyl)piperidin-4-yl]-[(2S)-3-methylbutan-2-yl]azanium Openeye Name: [1-(3,5-dimethylphenyl)-4-piperidyl]-[(1S)-1,2-dimethylpropyl]ammonium CAS Name: [1-(3,5-dimethylphenyl)-4-piperidinyl]-[(2S)-3-methylbutan-2-yl]ammonium IUPAC Name: [1-(3,5-dimethylphenyl)piperidin-4-yl]-[(2S)-3-methylbutan-2-yl]azanium Traditional Name: [1-(3,5-dimethylphenyl)-4-piperidyl]-[(1S)-1,2-dimethylpropyl]ammonium Formula: C18H31N2+ MolecularWeight: 275.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2CCC(CC2)[NH2+]C(C)C(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2CCC(CC2)[NH2+][C@@H](C)C(C)C)C

InChI

InChI=1S/C18H30N2/c1-13(2)16(5)19-17-6-8-20(9-7-17)18-11-14(3)10-15(4)12-18/h10-13,16-17,19H,6-9H2,1-5H3/p+1/t16-/m0/s1