2-methanoyl-4,6-dimethyl-1-(phenylmethyl)pyrrolo[2,3-b]pyridine-3-carbonitrile

Systemtic Name: 2-methanoyl-4,6-dimethyl-1-(phenylmethyl)pyrrolo[2,3-b]pyridine-3-carbonitrile Openeye Name: 1-benzyl-2-formyl-4,6-dimethyl-pyrrolo[2,3-b]pyridine-3-carbonitrile CAS Name: 2-formyl-4,6-dimethyl-1-(phenylmethyl)-3-pyrrolo[2,3-b]pyridinecarbonitrile IUPAC Name: 1-benzyl-2-formyl-4,6-dimethylpyrrolo[2,3-b]pyridine-3-carbonitrile Traditional Name: 1-benzyl-2-formyl-4,6-dimethyl-pyrrolo[2,3-b]pyridine-3-carbonitrile Formula: C18H15N3O MolecularWeight: 289.3312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(N2CC3=CC=CC=C3)C=O)C#N)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(N2CC3=CC=CC=C3)C=O)C#N)C

InChI

InChI=1S/C18H15N3O/c1-12-8-13(2)20-18-17(12)15(9-19)16(11-22)21(18)10-14-6-4-3-5-7-14/h3-8,11H,10H2,1-2H3