5-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxidanylidene-oxolan-3-yl]amino]-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxidanylidene-oxolan-3-yl]amino]-1H-pyrazole-4-carbonitrile Openeye Name: 5-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxo-tetrahydrofuran-3-yl]amino]-1H-pyrazole-4-carbonitrile CAS Name: 5-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxo-3-oxolanyl]amino]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxooxolan-3-yl]amino]-1H-pyrazole-4-carbonitrile Traditional Name: 5-[[5-(2,5-dimethoxyphenyl)-2-keto-5-methyl-tetrahydrofuran-3-yl]amino]-1H-pyrazole-4-carbonitrile Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(=O)O1)NC2=C(C=NN2)C#N)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1(CC(C(=O)O1)NC2=C(C=NN2)C#N)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C17H18N4O4/c1-17(12-6-11(23-2)4-5-14(12)24-3)7-13(16(22)25-17)20-15-10(8-18)9-19-21-15/h4-6,9,13H,7H2,1-3H3,(H2,19,20,21)