[(2R)-2-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(3-chloro-4-hydroxy-5-methoxy-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-(3-chloro-4-hydroxy-5-methoxy-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C16H27ClN2O2+2 MolecularWeight: 314.85078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25ClN2O2/c1-3-12-6-4-5-7-19(12)14(10-18)11-8-13(17)16(20)15(9-11)21-2/h8-9,12,14,20H,3-7,10,18H2,1-2H3/p+2/t12-,14-/m0/s1