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

Systemtic Name: 4-[3-(3-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzenecarbonitrile Openeye Name: 4-[3-(3-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile CAS Name: 4-[3-(3-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile IUPAC Name: 4-[3-(3-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile Traditional Name: 4-[3-(3-bromophenyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzonitrile Formula: C18H13BrN4 MolecularWeight: 365.22662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrN4/c19-14-3-1-2-13(10-14)17-16-8-9-21-18(16)23(22-17)15-6-4-12(11-20)5-7-15/h1-7,10,22H,8-9H2