[2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-chloranylbenzoate

Systemtic Name: [2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-chloranylbenzoate Openeye Name: [2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [2-[(5-cyclopropyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-cyclopropyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-keto-ethyl] ester Formula: C21H18ClN3O3 MolecularWeight: 395.83892

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)NC(=O)COC(=O)C3=CC=CC=C3Cl)C4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NN(C(=C2)NC(=O)COC(=O)C3=CC=CC=C3Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H18ClN3O3/c22-17-9-5-4-8-16(17)21(27)28-13-20(26)23-19-12-18(14-10-11-14)24-25(19)15-6-2-1-3-7-15/h1-9,12,14H,10-11,13H2,(H,23,26)