[(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(4-propan-2-ylphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(4-propan-2-ylphenyl)ethyl]azanium Openeye Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(4-isopropylphenyl)ethyl]ammonium CAS Name: [(2R)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]-2-(4-propan-2-ylphenyl)ethyl]ammonium IUPAC Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(4-propan-2-ylphenyl)ethyl]azanium Traditional Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-p-cumenyl-ethyl]ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1C(C[NH3+])C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC[C@H]1CCCC[NH+]1[C@@H](C[NH3+])C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C18H30N2/c1-4-17-7-5-6-12-20(17)18(13-19)16-10-8-15(9-11-16)14(2)3/h8-11,14,17-18H,4-7,12-13,19H2,1-3H3/p+2/t17-,18-/m0/s1