[2-[[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [2-[[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [2-[[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]amino]-2-oxo-ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [2-[[2-(4-fluorophenyl)-5-methyl-3-pyrazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]amino]-2-oxoethyl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2-[[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]amino]-2-keto-ethyl] ester Formula: C19H16ClFN4O3 MolecularWeight: 402.806743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)COC(=O)C2=CC(=C(C=C2)Cl)N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)COC(=O)C2=CC(=C(C=C2)Cl)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H16ClFN4O3/c1-11-8-17(25(24-11)14-5-3-13(21)4-6-14)23-18(26)10-28-19(27)12-2-7-15(20)16(22)9-12/h2-9H,10,22H2,1H3,(H,23,26)