2-chloranyl-N-[1-(3-chlorophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[1-(3-chlorophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[1-(3-chlorophenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]-5-nitro-benzamide CAS Name: 2-chloro-N-[1-(3-chlorophenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[1-(3-chlorophenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[1-(3-chlorophenyl)-4-keto-pyrazolo[3,4-d]pyrimidin-5-yl]-5-nitro-benzamide Formula: C18H10Cl2N6O4 MolecularWeight: 445.2158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)N2C3=C(C=N2)C(=O)N(C=N3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC(=C1)Cl)N2C3=C(C=N2)C(=O)N(C=N3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H10Cl2N6O4/c19-10-2-1-3-11(6-10)25-16-14(8-22-25)18(28)24(9-21-16)23-17(27)13-7-12(26(29)30)4-5-15(13)20/h1-9H,(H,23,27)