diethyl 5-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxyethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxyethanoylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxyacetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]ethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxyacetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxyacetyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C25H23N5O6 MolecularWeight: 489.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)COC2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)COC2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C25H23N5O6/c1-3-34-24(32)16-10-17(25(33)35-4-2)12-18(11-16)29-21(31)14-36-23-20-13-28-30(22(20)26-15-27-23)19-8-6-5-7-9-19/h5-13,15H,3-4,14H2,1-2H3,(H,29,31)