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

Systemtic Name: 6-azanyl-4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-3-(2,5-dimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-3-(2,5-dimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-3-(2,5-dimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-3-(2,5-dimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-3-(2,5-dimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C23H21BrN4O5 MolecularWeight: 513.34064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=C(OC3=NNC(=C23)C4=C(C=CC(=C4)OC)OC)N)C#N)Br)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(OC3=NNC(=C23)C4=C(C=CC(=C4)OC)OC)N)C#N)Br)O

InChI

InChI=1S/C23H21BrN4O5/c1-4-32-17-8-11(7-15(24)21(17)29)18-14(10-25)22(26)33-23-19(18)20(27-28-23)13-9-12(30-2)5-6-16(13)31-3/h5-9,18,29H,4,26H2,1-3H3,(H,27,28)