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

Systemtic Name: 6-azanyl-3-tert-butyl-4-(4-chloranyl-1,3-benzodioxol-5-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-tert-butyl-4-(4-chloro-1,3-benzodioxol-5-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-tert-butyl-4-(4-chloro-1,3-benzodioxol-5-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-tert-butyl-4-(4-chloro-1,3-benzodioxol-5-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-tert-butyl-4-(4-chloro-1,3-benzodioxol-5-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C18H17ClN4O3 MolecularWeight: 372.80558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(C(=C(OC2=NN1)N)C#N)C3=C(C4=C(C=C3)OCO4)Cl

Isomeric SMILES

CC(C)(C)C1=C2C(C(=C(OC2=NN1)N)C#N)C3=C(C4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C18H17ClN4O3/c1-18(2,3)15-12-11(9(6-20)16(21)26-17(12)23-22-15)8-4-5-10-14(13(8)19)25-7-24-10/h4-5,11H,7,21H2,1-3H3,(H,22,23)