[1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] 2-(1-phenylpyrazol-4-yl)ethanoate

Systemtic Name: [1-(4-ethoxyphenyl)-1-oxidanylidene-propan-2-yl] 2-(1-phenylpyrazol-4-yl)ethanoate Openeye Name: [2-(4-ethoxyphenyl)-1-methyl-2-oxo-ethyl] 2-(1-phenylpyrazol-4-yl)acetate CAS Name: 2-(1-phenyl-4-pyrazolyl)acetic acid [1-(4-ethoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethoxyphenyl)-1-oxopropan-2-yl] 2-(1-phenylpyrazol-4-yl)acetate Traditional Name: 2-(1-phenylpyrazol-4-yl)acetic acid (2-keto-1-methyl-2-p-phenetyl-ethyl) ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C(C)OC(=O)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C(C)OC(=O)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O4/c1-3-27-20-11-9-18(10-12-20)22(26)16(2)28-21(25)13-17-14-23-24(15-17)19-7-5-4-6-8-19/h4-12,14-16H,3,13H2,1-2H3