4-[2-[1-(2-nitrophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[1-(2-nitrophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[1-(2-nitrophenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[1-(2-nitrophenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[1-(2-nitrophenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[4-keto-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-5-yl]acetyl]amino]benzamide Formula: C20H15N7O5 MolecularWeight: 433.377

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H15N7O5/c21-18(29)12-5-7-13(8-6-12)24-17(28)10-25-11-22-19-14(20(25)30)9-23-26(19)15-3-1-2-4-16(15)27(31)32/h1-9,11H,10H2,(H2,21,29)(H,24,28)