4-[[(3S,4R)-4-(4-fluorophenyl)piperidin-1-ium-3-yl]methoxy]-2-methoxy-phenol

Systemtic Name: 4-[[(3S,4R)-4-(4-fluorophenyl)piperidin-1-ium-3-yl]methoxy]-2-methoxy-phenol Openeye Name: 4-[[(3S,4R)-4-(4-fluorophenyl)piperidin-1-ium-3-yl]methoxy]-2-methoxy-phenol CAS Name: 4-[[(3S,4R)-4-(4-fluorophenyl)-3-piperidin-1-iumyl]methoxy]-2-methoxyphenol IUPAC Name: 4-[[(3S,4R)-4-(4-fluorophenyl)piperidin-1-ium-3-yl]methoxy]-2-methoxyphenol Traditional Name: 4-[[(3S,4R)-4-(4-fluorophenyl)piperidin-1-ium-3-yl]methoxy]-2-methoxy-phenol Formula: C19H23FNO3+ MolecularWeight: 332.389223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC2C[NH2+]CCC2C3=CC=C(C=C3)F)O

Isomeric SMILES

COC1=C(C=CC(=C1)OC[C@@H]2C[NH2+]CC[C@H]2C3=CC=C(C=C3)F)O

InChI

InChI=1S/C19H22FNO3/c1-23-19-10-16(6-7-18(19)22)24-12-14-11-21-9-8-17(14)13-2-4-15(20)5-3-13/h2-7,10,14,17,21-22H,8-9,11-12H2,1H3/p+1/t14-,17-/m0/s1