1-(2-methoxyphenyl)-3-[2-[1-[(2R)-1-methylpiperidin-1-ium-2-yl]carbonylpiperidin-4-yl]pyrazol-3-yl]urea

Systemtic Name: 1-(2-methoxyphenyl)-3-[2-[1-[(2R)-1-methylpiperidin-1-ium-2-yl]carbonylpiperidin-4-yl]pyrazol-3-yl]urea Openeye Name: 1-(2-methoxyphenyl)-3-[2-[1-[(2R)-1-methylpiperidin-1-ium-2-carbonyl]-4-piperidyl]pyrazol-3-yl]urea CAS Name: 1-(2-methoxyphenyl)-3-[2-[1-[[(2R)-1-methyl-2-piperidin-1-iumyl]-oxomethyl]-4-piperidinyl]-3-pyrazolyl]urea IUPAC Name: 1-(2-methoxyphenyl)-3-[2-[1-[(2R)-1-methylpiperidin-1-ium-2-carbonyl]piperidin-4-yl]pyrazol-3-yl]urea Traditional Name: 1-(2-methoxyphenyl)-3-[2-[1-[(2R)-1-methylpiperidin-1-ium-2-carbonyl]-4-piperidyl]pyrazol-3-yl]urea Formula: C23H33N6O3+ MolecularWeight: 441.54652

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCCC1C(=O)N2CCC(CC2)N3C(=CC=N3)NC(=O)NC4=CC=CC=C4OC

Isomeric SMILES

C[NH+]1CCCC[C@@H]1C(=O)N2CCC(CC2)N3C(=CC=N3)NC(=O)NC4=CC=CC=C4OC

InChI

InChI=1S/C23H32N6O3/c1-27-14-6-5-8-19(27)22(30)28-15-11-17(12-16-28)29-21(10-13-24-29)26-23(31)25-18-7-3-4-9-20(18)32-2/h3-4,7,9-10,13,17,19H,5-6,8,11-12,14-16H2,1-2H3,(H2,25,26,31)/p+1/t19-/m1/s1