(3S)-1-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperidin-1-ium-3-ol

Systemtic Name: (3S)-1-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperidin-1-ium-3-ol Openeye Name: (3S)-1-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperidin-1-ium-3-ol CAS Name: (3S)-1-[(4-methoxy-2,3-dimethylphenyl)methyl]-3-piperidin-1-iumol IUPAC Name: (3S)-1-[(4-methoxy-2,3-dimethylphenyl)methyl]piperidin-1-ium-3-ol Traditional Name: (3S)-1-(4-methoxy-2,3-dimethyl-benzyl)piperidin-1-ium-3-ol Formula: C15H24NO2+ MolecularWeight: 250.35656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OC)C[NH+]2CCCC(C2)O

Isomeric SMILES

CC1=C(C=CC(=C1C)OC)C[NH+]2CCC[C@@H](C2)O

InChI

InChI=1S/C15H23NO2/c1-11-12(2)15(18-3)7-6-13(11)9-16-8-4-5-14(17)10-16/h6-7,14,17H,4-5,8-10H2,1-3H3/p+1/t14-/m0/s1