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

Systemtic Name: 6-azanyl-1-(3-bromophenyl)-4-(3-methoxy-4-oxidanyl-phenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-1-(3-bromophenyl)-4-(4-hydroxy-3-methoxy-phenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-1-(3-bromophenyl)-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-1-(3-bromophenyl)-4-(4-hydroxy-3-methoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-1-(3-bromophenyl)-4-(4-hydroxy-3-methoxy-phenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C21H17BrN4O3 MolecularWeight: 453.28868

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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)O)OC)C4=CC(=CC=C4)Br

Isomeric SMILES

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

InChI

InChI=1S/C21H17BrN4O3/c1-11-18-19(12-6-7-16(27)17(8-12)28-2)15(10-23)20(24)29-21(18)26(25-11)14-5-3-4-13(22)9-14/h3-9,20,27H,24H2,1-2H3