[(3S)-1-[[5-(2-chlorophenyl)furan-2-yl]methyl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[[5-(2-chlorophenyl)furan-2-yl]methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[[5-(2-chlorophenyl)-2-furyl]methyl]piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[[5-(2-chlorophenyl)-2-furanyl]methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[[5-(2-chlorophenyl)furan-2-yl]methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-[[5-(2-chlorophenyl)-2-furyl]methyl]piperidin-1-ium-3-yl]methanol Formula: C17H21ClNO2+ MolecularWeight: 306.80714

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(O2)C3=CC=CC=C3Cl)CO

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=C(O2)C3=CC=CC=C3Cl)CO

InChI

InChI=1S/C17H20ClNO2/c18-16-6-2-1-5-15(16)17-8-7-14(21-17)11-19-9-3-4-13(10-19)12-20/h1-2,5-8,13,20H,3-4,9-12H2/p+1/t13-/m0/s1