[2-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxypropanoate

Systemtic Name: [2-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxypropanoate Openeye Name: [2-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-2-oxo-ethyl] (2R)-2-phenoxypropanoate CAS Name: (2R)-2-phenoxypropanoic acid [2-[[5-(4-chlorophenyl)-2-methyl-3-pyrazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[5-(4-chlorophenyl)-2-methylpyrazol-3-yl]amino]-2-oxoethyl] (2R)-2-phenoxypropanoate Traditional Name: (2R)-2-phenoxypropionic acid [2-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-2-keto-ethyl] ester Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC(=NN1C)C2=CC=C(C=C2)Cl)OC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NC1=CC(=NN1C)C2=CC=C(C=C2)Cl)OC3=CC=CC=C3

InChI

InChI=1S/C21H20ClN3O4/c1-14(29-17-6-4-3-5-7-17)21(27)28-13-20(26)23-19-12-18(24-25(19)2)15-8-10-16(22)11-9-15/h3-12,14H,13H2,1-2H3,(H,23,26)/t14-/m1/s1