methyl 3-(1-ethyl-3-methyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxy-benzoate

Systemtic Name: methyl 3-(1-ethyl-3-methyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxy-benzoate Openeye Name: methyl 3-(1-ethyl-3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxy-benzoate CAS Name: 3-(1-ethyl-3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxybenzoic acid methyl ester IUPAC Name: methyl 3-(1-ethyl-3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxybenzoate Traditional Name: 3-(1-ethyl-4-keto-3-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxy-benzoic acid methyl ester Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OC)C2=NC(=O)C3=C(NN(C3=N2)CC)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)OC)C2=NC(=O)C3=C(NN(C3=N2)CC)C

InChI

InChI=1S/C19H22N4O4/c1-5-9-27-14-8-7-12(19(25)26-4)10-13(14)16-20-17-15(18(24)21-16)11(3)22-23(17)6-2/h7-8,10,22H,5-6,9H2,1-4H3