3-ethanoyl-1-(isocyanomethyl)-2,6-dimethyl-4H-pyrrolo[3,2-b]pyridin-7-one

Systemtic Name: 3-ethanoyl-1-(isocyanomethyl)-2,6-dimethyl-4H-pyrrolo[3,2-b]pyridin-7-one Openeye Name: 3-acetyl-1-(isocyanomethyl)-2,6-dimethyl-4H-pyrrolo[3,2-b]pyridin-7-one CAS Name: 3-acetyl-1-(isocyanomethyl)-2,6-dimethyl-4H-pyrrolo[3,2-b]pyridin-7-one IUPAC Name: 3-acetyl-1-(isocyanomethyl)-2,6-dimethyl-4H-pyrrolo[3,2-b]pyridin-7-one Traditional Name: 3-acetyl-1-(isocyanomethyl)-2,6-dimethyl-4H-pyrrolo[3,2-b]pyridin-7-one Formula: C13H13N3O2 MolecularWeight: 243.26122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C(C1=O)N(C(=C2C(=O)C)C)C[N+]#[C-]

Isomeric SMILES

CC1=CNC2=C(C1=O)N(C(=C2C(=O)C)C)C[N+]#[C-]

InChI

InChI=1S/C13H13N3O2/c1-7-5-15-11-10(9(3)17)8(2)16(6-14-4)12(11)13(7)18/h5H,6H2,1-3H3,(H,15,18)