6-azanyl-3-(1,3-benzodioxol-5-yl)-4-(3-ethoxy-4-oxidanyl-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-3-(1,3-benzodioxol-5-yl)-4-(3-ethoxy-4-oxidanyl-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(3-ethoxy-4-hydroxy-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(3-ethoxy-4-hydroxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(3-ethoxy-4-hydroxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(3-ethoxy-4-hydroxy-phenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C22H18N4O5 MolecularWeight: 418.40212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(OC3=NNC(=C23)C4=CC5=C(C=C4)OCO5)N)C#N)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(OC3=NNC(=C23)C4=CC5=C(C=C4)OCO5)N)C#N)O

InChI

InChI=1S/C22H18N4O5/c1-2-28-16-7-11(3-5-14(16)27)18-13(9-23)21(24)31-22-19(18)20(25-26-22)12-4-6-15-17(8-12)30-10-29-15/h3-8,18,27H,2,10,24H2,1H3,(H,25,26)