6-azanyl-3-(4-bromophenyl)-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-3-(4-bromophenyl)-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-(4-bromophenyl)-4-(4-hydroxy-3,5-dimethoxy-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-(4-bromophenyl)-4-(4-hydroxy-3,5-dimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-(4-bromophenyl)-4-(4-hydroxy-3,5-dimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-(4-bromophenyl)-4-(4-hydroxy-3,5-dimethoxy-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C21H17BrN4O4 MolecularWeight: 469.28808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C2C(=C(OC3=NNC(=C23)C4=CC=C(C=C4)Br)N)C#N

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C2C(=C(OC3=NNC(=C23)C4=CC=C(C=C4)Br)N)C#N

InChI

InChI=1S/C21H17BrN4O4/c1-28-14-7-11(8-15(29-2)19(14)27)16-13(9-23)20(24)30-21-17(16)18(25-26-21)10-3-5-12(22)6-4-10/h3-8,16,27H,24H2,1-2H3,(H,25,26)