6-azanyl-1-(4-iodophenyl)-4-(4-methoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-1-(4-iodophenyl)-4-(4-methoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-1-(4-iodophenyl)-4-(4-methoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-1-(4-iodophenyl)-4-(4-methoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-1-(4-iodophenyl)-4-(4-methoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-1-(4-iodophenyl)-4-(4-methoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C21H17IN4O2 MolecularWeight: 484.28975

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=C(C(O2)N)C#N)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)I

Isomeric SMILES

CC1=NN(C2=C1C(=C(C(O2)N)C#N)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)I

InChI

InChI=1S/C21H17IN4O2/c1-12-18-19(13-3-9-16(27-2)10-4-13)17(11-23)20(24)28-21(18)26(25-12)15-7-5-14(22)6-8-15/h3-10,20H,24H2,1-2H3