[1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-oxidanylidene-butan-2-yl] 3,4-dimethoxybenzoate

Systemtic Name: [1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-oxidanylidene-butan-2-yl] 3,4-dimethoxybenzoate Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazole-4-carbonyl)propyl 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-oxobutan-2-yl] ester IUPAC Name: [1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-oxobutan-2-yl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid 1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazoline-4-carbonyl)propyl ester Formula: C24H26N2O6 MolecularWeight: 438.47304

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=C(N(N(C1=O)C2=CC=CC=C2)C)C)OC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC(C(=O)C1=C(N(N(C1=O)C2=CC=CC=C2)C)C)OC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H26N2O6/c1-6-18(32-24(29)16-12-13-19(30-4)20(14-16)31-5)22(27)21-15(2)25(3)26(23(21)28)17-10-8-7-9-11-17/h7-14,18H,6H2,1-5H3