3-[(5-oxidanylidene-4-phenyl-pyrrolo[3,2-b]pyridin-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(5-oxidanylidene-4-phenyl-pyrrolo[3,2-b]pyridin-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(5-oxo-4-phenyl-pyrrolo[3,2-b]pyridin-1-yl)methyl]benzonitrile CAS Name: 3-[(5-oxo-4-phenyl-1-pyrrolo[3,2-b]pyridinyl)methyl]benzonitrile IUPAC Name: 3-[(5-oxo-4-phenylpyrrolo[3,2-b]pyridin-1-yl)methyl]benzonitrile Traditional Name: 3-[(5-keto-4-phenyl-pyrrolo[3,2-b]pyridin-1-yl)methyl]benzonitrile Formula: C21H15N3O MolecularWeight: 325.3633

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=CC2=O)N(C=C3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=CC2=O)N(C=C3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H15N3O/c22-14-16-5-4-6-17(13-16)15-23-12-11-20-19(23)9-10-21(25)24(20)18-7-2-1-3-8-18/h1-13H,15H2