[(2R)-2-(5-chloranyl-2-ethoxy-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(5-chloranyl-2-ethoxy-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(5-chloro-2-ethoxy-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(5-chloro-2-ethoxyphenyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(5-chloro-2-ethoxyphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(5-chloro-2-ethoxy-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]ammonium Formula: C16H27ClN2O+2 MolecularWeight: 298.85138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(C[NH3+])[NH+]2CCC(CC2)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)[C@H](C[NH3+])[NH+]2CCC(CC2)C

InChI

InChI=1S/C16H25ClN2O/c1-3-20-16-5-4-13(17)10-14(16)15(11-18)19-8-6-12(2)7-9-19/h4-5,10,12,15H,3,6-9,11,18H2,1-2H3/p+2/t15-/m0/s1