[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]ethanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]ethanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]acetate CAS Name: 2-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]acetic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 2-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]acetate Traditional Name: 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]acetic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)COC(=O)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CC1NC(=O)COC(=O)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN3O3/c23-17-8-6-15(7-9-17)22-16(13-26(25-22)19-4-2-1-3-5-19)12-21(28)29-14-20(27)24-18-10-11-18/h1-9,13,18H,10-12,14H2,(H,24,27)