1-[3-(1-methylpiperidin-4-yl)carbonylphenyl]-3-[3-(trifluoromethyloxy)phenyl]urea; 2-oxidanylpropanoate

Systemtic Name: 1-[3-(1-methylpiperidin-4-yl)carbonylphenyl]-3-[3-(trifluoromethyloxy)phenyl]urea; 2-oxidanylpropanoate Openeye Name: 2-hydroxypropanoate; 1-[3-(1-methylpiperidine-4-carbonyl)phenyl]-3-[3-(trifluoromethoxy)phenyl]urea CAS Name: 2-hydroxypropanoate; 1-[3-[(1-methyl-4-piperidinyl)-oxomethyl]phenyl]-3-[3-(trifluoromethoxy)phenyl]urea IUPAC Name: 2-hydroxypropanoate; 1-[3-(1-methylpiperidine-4-carbonyl)phenyl]-3-[3-(trifluoromethoxy)phenyl]urea Traditional Name: lactate; 1-[3-(1-methylisonipecotoyl)phenyl]-3-[3-(trifluoromethoxy)phenyl]urea Formula: C24H27F3N3O6- MolecularWeight: 510.48289

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])O.CN1CCC(CC1)C(=O)C2=CC(=CC=C2)NC(=O)NC3=CC(=CC=C3)OC(F)(F)F

Isomeric SMILES

CC(C(=O)[O-])O.CN1CCC(CC1)C(=O)C2=CC(=CC=C2)NC(=O)NC3=CC(=CC=C3)OC(F)(F)F

InChI

InChI=1S/C21H22F3N3O3.C3H6O3/c1-27-10-8-14(9-11-27)19(28)15-4-2-5-16(12-15)25-20(29)26-17-6-3-7-18(13-17)30-21(22,23)24;1-2(4)3(5)6/h2-7,12-14H,8-11H2,1H3,(H2,25,26,29);2,4H,1H3,(H,5,6)/p-1