2-[3,6-bis(oxidanylidene)-1,4-diphenyl-2H-pyrrolo[3,4-c]pyrrol-5-yl]ethanenitrile

Systemtic Name: 2-[3,6-bis(oxidanylidene)-1,4-diphenyl-2H-pyrrolo[3,4-c]pyrrol-5-yl]ethanenitrile Openeye Name: 2-(3,6-dioxo-1,4-diphenyl-2H-pyrrolo[3,4-c]pyrrol-5-yl)acetonitrile CAS Name: 2-(3,6-dioxo-1,4-diphenyl-2H-pyrrolo[3,4-c]pyrrol-5-yl)acetonitrile IUPAC Name: 2-(3,6-dioxo-1,4-diphenyl-2H-pyrrolo[3,4-c]pyrrol-5-yl)acetonitrile Traditional Name: 2-(3,6-diketo-1,4-diphenyl-2H-pyrrolo[3,4-c]pyrrol-5-yl)acetonitrile Formula: C20H13N3O2 MolecularWeight: 327.33612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=C(N(C3=O)CC#N)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=C(N(C3=O)CC#N)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C20H13N3O2/c21-11-12-23-18(14-9-5-2-6-10-14)16-15(20(23)25)17(22-19(16)24)13-7-3-1-4-8-13/h1-10H,12H2,(H,22,24)