(3S)-3-[(4-chloranyl-2-cyclohexyl-phenoxy)methyl]piperidin-1-ium

Systemtic Name: (3S)-3-[(4-chloranyl-2-cyclohexyl-phenoxy)methyl]piperidin-1-ium Openeye Name: (3S)-3-[(4-chloro-2-cyclohexyl-phenoxy)methyl]piperidin-1-ium CAS Name: (3S)-3-[(4-chloro-2-cyclohexylphenoxy)methyl]piperidin-1-ium IUPAC Name: (3S)-3-[(4-chloro-2-cyclohexylphenoxy)methyl]piperidin-1-ium Traditional Name: (3S)-3-[(4-chloro-2-cyclohexyl-phenoxy)methyl]piperidin-1-ium Formula: C18H27ClNO+ MolecularWeight: 308.86608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OCC3CCC[NH2+]C3

Isomeric SMILES

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC[C@H]3CCC[NH2+]C3

InChI

InChI=1S/C18H26ClNO/c19-16-8-9-18(21-13-14-5-4-10-20-12-14)17(11-16)15-6-2-1-3-7-15/h8-9,11,14-15,20H,1-7,10,12-13H2/p+1/t14-/m0/s1