[2-(6-azanyl-5-cyano-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] 3-nitrobenzoate

Systemtic Name: [2-(6-azanyl-5-cyano-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] 3-nitrobenzoate Openeye Name: [2-(6-amino-5-cyano-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(6-amino-5-cyano-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester IUPAC Name: [2-(6-amino-5-cyano-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(6-amino-5-cyano-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester Formula: C26H17N5O5 MolecularWeight: 479.44368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=CC=C4OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=CC=C4OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H17N5O5/c27-14-19-21(22-23(15-7-2-1-3-8-15)29-30-25(22)36-24(19)28)18-11-4-5-12-20(18)35-26(32)16-9-6-10-17(13-16)31(33)34/h1-13,21H,28H2,(H,29,30)