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

Systemtic Name: 6-azanyl-3-(1,3-benzodioxol-5-yl)-4-(4-ethylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(4-ethylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(4-ethylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(4-ethylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(4-ethylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=C(OC3=NNC(=C23)C4=CC5=C(C=C4)OCO5)N)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2C(=C(OC3=NNC(=C23)C4=CC5=C(C=C4)OCO5)N)C#N

InChI

InChI=1S/C22H18N4O3/c1-2-12-3-5-13(6-4-12)18-15(10-23)21(24)29-22-19(18)20(25-26-22)14-7-8-16-17(9-14)28-11-27-16/h3-9,18H,2,11,24H2,1H3,(H,25,26)