(3S)-3-(2-methoxy-4-methyl-phenoxy)piperidin-1-ium

Systemtic Name: (3S)-3-(2-methoxy-4-methyl-phenoxy)piperidin-1-ium Openeye Name: (3S)-3-(2-methoxy-4-methyl-phenoxy)piperidin-1-ium CAS Name: (3S)-3-(2-methoxy-4-methylphenoxy)piperidin-1-ium IUPAC Name: (3S)-3-(2-methoxy-4-methylphenoxy)piperidin-1-ium Traditional Name: (3S)-3-(2-methoxy-4-methyl-phenoxy)piperidin-1-ium Formula: C13H20NO2+ MolecularWeight: 222.3034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2CCC[NH2+]C2)OC

Isomeric SMILES

CC1=CC(=C(C=C1)O[C@H]2CCC[NH2+]C2)OC

InChI

InChI=1S/C13H19NO2/c1-10-5-6-12(13(8-10)15-2)16-11-4-3-7-14-9-11/h5-6,8,11,14H,3-4,7,9H2,1-2H3/p+1/t11-/m0/s1