3-cyano-2-[(4-methoxyphenyl)amino]-5-(4-nitrophenyl)pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 3-cyano-2-[(4-methoxyphenyl)amino]-5-(4-nitrophenyl)pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 3-cyano-2-(4-methoxyanilino)-5-(4-nitrophenyl)pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 3-cyano-2-(4-methoxyanilino)-5-(4-nitrophenyl)-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 3-cyano-2-(4-methoxyanilino)-5-(4-nitrophenyl)pyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 3-cyano-5-(4-nitrophenyl)-2-(p-anisidino)pyrazolo[1,5-a]pyrimidin-7-olate Formula: C20H13N6O4- MolecularWeight: 401.35502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN3C(=CC(=NC3=C2C#N)C4=CC=C(C=C4)[N+](=O)[O-])[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN3C(=CC(=NC3=C2C#N)C4=CC=C(C=C4)[N+](=O)[O-])[O-]

InChI

InChI=1S/C20H14N6O4/c1-30-15-8-4-13(5-9-15)22-19-16(11-21)20-23-17(10-18(27)25(20)24-19)12-2-6-14(7-3-12)26(28)29/h2-10,27H,1H3,(H,22,24)/p-1