(4-butyl-5-oxidanylidene-1,2-diphenyl-pyrazol-3-yl)oxymethyl ethanoate

Systemtic Name: (4-butyl-5-oxidanylidene-1,2-diphenyl-pyrazol-3-yl)oxymethyl ethanoate Openeye Name: (4-butyl-5-oxo-1,2-diphenyl-pyrazol-3-yl)oxymethyl acetate CAS Name: acetic acid (4-butyl-5-oxo-1,2-diphenyl-3-pyrazolyl)oxymethyl ester IUPAC Name: (4-butyl-5-oxo-1,2-diphenylpyrazol-3-yl)oxymethyl acetate Traditional Name: acetic acid (4-butyl-5-keto-1,2-diphenyl-3-pyrazolin-3-yl)oxymethyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)OCOC(=O)C

Isomeric SMILES

CCCCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)OCOC(=O)C

InChI

InChI=1S/C22H24N2O4/c1-3-4-15-20-21(26)23(18-11-7-5-8-12-18)24(19-13-9-6-10-14-19)22(20)28-16-27-17(2)25/h5-14H,3-4,15-16H2,1-2H3