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

Systemtic Name: (3S)-1-[(4-methoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-3-ol Openeye Name: (3S)-1-[(2-hydroxy-4-methoxy-phenyl)methyl]piperidin-1-ium-3-ol CAS Name: (3S)-1-[(2-hydroxy-4-methoxyphenyl)methyl]-3-piperidin-1-iumol IUPAC Name: (3S)-1-[(2-hydroxy-4-methoxyphenyl)methyl]piperidin-1-ium-3-ol Traditional Name: (3S)-1-(2-hydroxy-4-methoxy-benzyl)piperidin-1-ium-3-ol Formula: C13H20NO3+ MolecularWeight: 238.3028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C[NH+]2CCCC(C2)O)O

Isomeric SMILES

COC1=CC(=C(C=C1)C[NH+]2CCC[C@@H](C2)O)O

InChI

InChI=1S/C13H19NO3/c1-17-12-5-4-10(13(16)7-12)8-14-6-2-3-11(15)9-14/h4-5,7,11,15-16H,2-3,6,8-9H2,1H3/p+1/t11-/m0/s1