4-chloranyl-N'-[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: 4-chloranyl-N'-[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: 4-chloro-3-nitro-N'-[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzohydrazide CAS Name: 4-chloro-N'-[1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N'-[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: 4-chloro-3-nitro-N'-[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzohydrazide Formula: C19H14ClN7O3 MolecularWeight: 423.81256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NNC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NNC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H14ClN7O3/c1-11-2-5-13(6-3-11)26-18-14(9-23-26)17(21-10-22-18)24-25-19(28)12-4-7-15(20)16(8-12)27(29)30/h2-10H,1H3,(H,25,28)(H,21,22,24)