(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-(diethylamino)-3-phenyl-propanoate

Systemtic Name: (4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-(diethylamino)-3-phenyl-propanoate Openeye Name: (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-(diethylamino)-3-phenyl-propanoate CAS Name: 2-(diethylamino)-3-phenylpropanoic acid (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl ester IUPAC Name: (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-(diethylamino)-3-phenylpropanoate Traditional Name: 2-(diethylamino)-3-phenyl-propionic acid (4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl ester Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC1=CC=CC=C1)C(=O)OCN2C3=NC=NC(=O)C3=CN2

Isomeric SMILES

CCN(CC)C(CC1=CC=CC=C1)C(=O)OCN2C3=NC=NC(=O)C3=CN2

InChI

InChI=1S/C19H23N5O3/c1-3-23(4-2)16(10-14-8-6-5-7-9-14)19(26)27-13-24-17-15(11-22-24)18(25)21-12-20-17/h5-9,11-12,16,22H,3-4,10,13H2,1-2H3