6-azanyl-1-(4-bromophenyl)-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-1-(4-bromophenyl)-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-1-(4-bromophenyl)-4-(4-hydroxy-3,5-dimethoxy-phenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-1-(4-bromophenyl)-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-1-(4-bromophenyl)-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-1-(4-bromophenyl)-4-(4-hydroxy-3,5-dimethoxy-phenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C22H19BrN4O4 MolecularWeight: 483.31466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=C(C(O2)N)C#N)C3=CC(=C(C(=C3)OC)O)OC)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=NN(C2=C1C(=C(C(O2)N)C#N)C3=CC(=C(C(=C3)OC)O)OC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H19BrN4O4/c1-11-18-19(12-8-16(29-2)20(28)17(9-12)30-3)15(10-24)21(25)31-22(18)27(26-11)14-6-4-13(23)5-7-14/h4-9,21,28H,25H2,1-3H3