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

Systemtic Name: 1-(3-fluorophenyl)-3-[2-[1-(naphthalen-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]urea Openeye Name: 1-(3-fluorophenyl)-3-[2-[1-(2-naphthylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]urea CAS Name: 1-(3-fluorophenyl)-3-[2-[1-(2-naphthalenylmethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]urea IUPAC Name: 1-(3-fluorophenyl)-3-[2-[1-(naphthalen-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]urea Traditional Name: 1-(3-fluorophenyl)-3-[2-[1-(2-naphthylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]urea Formula: C26H27FN5O+ MolecularWeight: 444.523883

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)NC3=CC(=CC=C3)F)CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)NC3=CC(=CC=C3)F)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H26FN5O/c27-22-6-3-7-23(17-22)29-26(33)30-25-10-13-28-32(25)24-11-14-31(15-12-24)18-19-8-9-20-4-1-2-5-21(20)16-19/h1-10,13,16-17,24H,11-12,14-15,18H2,(H2,29,30,33)/p+1