1-(3-fluorophenyl)-3-[2-[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]urea

Systemtic Name: 1-(3-fluorophenyl)-3-[2-[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]urea Openeye Name: 1-(3-fluorophenyl)-3-[2-[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]urea CAS Name: 1-(3-fluorophenyl)-3-[2-[1-(2-hydroxyethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]urea IUPAC Name: 1-(3-fluorophenyl)-3-[2-[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]urea Traditional Name: 1-(3-fluorophenyl)-3-[2-[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]urea Formula: C17H23FN5O2+ MolecularWeight: 348.395223

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)NC3=CC(=CC=C3)F)CCO

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)NC3=CC(=CC=C3)F)CCO

InChI

InChI=1S/C17H22FN5O2/c18-13-2-1-3-14(12-13)20-17(25)21-16-4-7-19-23(16)15-5-8-22(9-6-15)10-11-24/h1-4,7,12,15,24H,5-6,8-11H2,(H2,20,21,25)/p+1