5-[(5-chloranyl-2-methoxy-phenyl)methyl]-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(5-chloranyl-2-methoxy-phenyl)methyl]-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(5-chloro-2-methoxy-phenyl)methyl]-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(5-chloro-2-methoxyphenyl)methyl]-1-(2-nitrophenyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(5-chloro-2-methoxyphenyl)methyl]-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(5-chloro-2-methoxy-benzyl)-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H14ClN5O4 MolecularWeight: 411.79856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C19H14ClN5O4/c1-29-17-7-6-13(20)8-12(17)10-23-11-21-18-14(19(23)26)9-22-24(18)15-4-2-3-5-16(15)25(27)28/h2-9,11H,10H2,1H3