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

Systemtic Name: 6-azanyl-4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-1-(4-bromophenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-1-(4-bromophenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-1-(4-bromophenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-1-(4-bromophenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-1-(4-bromophenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C22H18Br2N4O3 MolecularWeight: 546.21132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2=C(C(OC3=C2C(=NN3C4=CC=C(C=C4)Br)C)N)C#N)Br)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2=C(C(OC3=C2C(=NN3C4=CC=C(C=C4)Br)C)N)C#N)Br)O

InChI

InChI=1S/C22H18Br2N4O3/c1-3-30-17-9-12(8-16(24)20(17)29)19-15(10-25)21(26)31-22-18(19)11(2)27-28(22)14-6-4-13(23)5-7-14/h4-9,21,29H,3,26H2,1-2H3