6-azanyl-3-tert-butyl-4-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-3-tert-butyl-4-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-tert-butyl-4-(4-hydroxy-3-methoxy-5-nitro-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-tert-butyl-4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-tert-butyl-4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-tert-butyl-4-(4-hydroxy-3-methoxy-5-nitro-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C18H19N5O5 MolecularWeight: 385.37396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C(=C3)OC)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C(=C3)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O5/c1-18(2,3)15-13-12(9(7-19)16(20)28-17(13)22-21-15)8-5-10(23(25)26)14(24)11(6-8)27-4/h5-6,12,24H,20H2,1-4H3,(H,21,22)