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

Systemtic Name: 6-azanyl-1-(4-iodophenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-1-(4-iodophenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-6H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-1-(4-iodophenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-6H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-1-(4-iodophenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-1-(4-iodophenyl)-3-methyl-4-(3,4,5-trimethoxyphenyl)-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C23H21IN4O4 MolecularWeight: 544.34171

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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)OC)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)OC)OC)C4=CC=C(C=C4)I

InChI

InChI=1S/C23H21IN4O4/c1-12-19-20(13-9-17(29-2)21(31-4)18(10-13)30-3)16(11-25)22(26)32-23(19)28(27-12)15-7-5-14(24)6-8-15/h5-10,22H,26H2,1-4H3