1-[2-[1-[(2-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(2-methoxyphenyl)urea

Systemtic Name: 1-[2-[1-[(2-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(2-methoxyphenyl)urea Openeye Name: 1-[2-[1-[(2-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(2-methoxyphenyl)urea CAS Name: 1-[2-[1-[(2-ethoxyphenyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-3-(2-methoxyphenyl)urea IUPAC Name: 1-[2-[1-[(2-ethoxyphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(2-methoxyphenyl)urea Traditional Name: 1-[2-[1-(2-ethoxybenzyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(2-methoxyphenyl)urea Formula: C25H32N5O3+ MolecularWeight: 450.55328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)NC4=CC=CC=C4OC

Isomeric SMILES

CCOC1=CC=CC=C1C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)NC4=CC=CC=C4OC

InChI

InChI=1S/C25H31N5O3/c1-3-33-22-10-6-4-8-19(22)18-29-16-13-20(14-17-29)30-24(12-15-26-30)28-25(31)27-21-9-5-7-11-23(21)32-2/h4-12,15,20H,3,13-14,16-18H2,1-2H3,(H2,27,28,31)/p+1