6-azanyl-4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-3-(3-ethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-3-(3-ethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-3-(3-ethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-3-(3-ethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-3-(3-ethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-3-m-phenetyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C23H21BrN4O4 MolecularWeight: 497.34124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=C(C(=C4)Br)O)OCC

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=C(C(=C4)Br)O)OCC

InChI

InChI=1S/C23H21BrN4O4/c1-3-30-14-7-5-6-12(8-14)20-19-18(15(11-25)22(26)32-23(19)28-27-20)13-9-16(24)21(29)17(10-13)31-4-2/h5-10,18,29H,3-4,26H2,1-2H3,(H,27,28)