[(2R)-2-[4-(2-methylphenoxy)phenyl]-2-piperidin-1-ium-1-yl-ethyl]azanium

Systemtic Name: [(2R)-2-[4-(2-methylphenoxy)phenyl]-2-piperidin-1-ium-1-yl-ethyl]azanium Openeye Name: [(2R)-2-[4-(2-methylphenoxy)phenyl]-2-piperidin-1-ium-1-yl-ethyl]ammonium CAS Name: [(2R)-2-[4-(2-methylphenoxy)phenyl]-2-(1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-[4-(2-methylphenoxy)phenyl]-2-piperidin-1-ium-1-ylethyl]azanium Traditional Name: [(2R)-2-[4-(2-methylphenoxy)phenyl]-2-piperidin-1-ium-1-yl-ethyl]ammonium Formula: C20H28N2O+2 MolecularWeight: 312.44912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC=C(C=C2)C(C[NH3+])[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1OC2=CC=C(C=C2)[C@H](C[NH3+])[NH+]3CCCCC3

InChI

InChI=1S/C20H26N2O/c1-16-7-3-4-8-20(16)23-18-11-9-17(10-12-18)19(15-21)22-13-5-2-6-14-22/h3-4,7-12,19H,2,5-6,13-15,21H2,1H3/p+2/t19-/m0/s1