4-[3-(4-iodophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[3-(4-iodophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzenecarbonitrile Openeye Name: 4-[3-(4-iodophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile CAS Name: 4-[3-(4-iodophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile IUPAC Name: 4-[3-(4-iodophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile Traditional Name: 4-[3-(4-iodophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile Formula: C18H13IN4 MolecularWeight: 412.22709

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C1=C(NN2C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)I

Isomeric SMILES

C1CN=C2C1=C(NN2C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)I

InChI

InChI=1S/C18H13IN4/c19-14-5-3-13(4-6-14)17-16-9-10-21-18(16)23(22-17)15-7-1-12(11-20)2-8-15/h1-8,22H,9-10H2