6-azanyl-4-(1,3-benzodioxol-5-yl)-3-methyl-1-(phenylmethyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

InChI

InChI=1S/C22H18N4O3/c1-13-19-20(15-7-8-17-18(9-15)28-12-27-17)16(10-23)21(24)29-22(19)26(25-13)11-14-5-3-2-4-6-14/h2-9,20H,11-12,24H2,1H3