2-[(2S)-4-[[5-(2-chlorophenyl)furan-2-yl]methyl]-1-propan-2-yl-piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[[5-(2-chlorophenyl)furan-2-yl]methyl]-1-propan-2-yl-piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[[5-(2-chlorophenyl)-2-furyl]methyl]-1-isopropyl-piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[[5-(2-chlorophenyl)-2-furanyl]methyl]-1-propan-2-yl-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[[5-(2-chlorophenyl)furan-2-yl]methyl]-1-propan-2-ylpiperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[[5-(2-chlorophenyl)-2-furyl]methyl]-1-isopropyl-piperazin-4-ium-2-yl]ethanol Formula: C20H28ClN2O2+ MolecularWeight: 363.90152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC[NH+](CC1CCO)CC2=CC=C(O2)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)N1CC[NH+](C[C@@H]1CCO)CC2=CC=C(O2)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H27ClN2O2/c1-15(2)23-11-10-22(13-16(23)9-12-24)14-17-7-8-20(25-17)18-5-3-4-6-19(18)21/h3-8,15-16,24H,9-14H2,1-2H3/p+1/t16-/m0/s1