5-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl]-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl]-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl]-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl]-1-(2-nitrophenyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl]-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl]-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H21N5O5 MolecularWeight: 471.46474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5[N+](=O)[O-])C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5[N+](=O)[O-])C(C)C

InChI

InChI=1S/C25H21N5O5/c1-14(2)17-10-18-16(9-23(31)35-22(18)8-15(17)3)12-28-13-26-24-19(25(28)32)11-27-29(24)20-6-4-5-7-21(20)30(33)34/h4-11,13-14H,12H2,1-3H3