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

Systemtic Name: [(2R)-2-(4-dimethylaminophenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(4-dimethylaminophenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(4-dimethylaminophenyl)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(4-dimethylaminophenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-(4-dimethylaminophenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29N3/c1-4-15-7-5-6-12-20(15)17(13-18)14-8-10-16(11-9-14)19(2)3/h8-11,15,17H,4-7,12-13,18H2,1-3H3/p+2/t15-,17-/m0/s1