4,5-dimethoxy-2-pyrrol-1-yl-benzenecarbonitrile

Systemtic Name: 4,5-dimethoxy-2-pyrrol-1-yl-benzenecarbonitrile Openeye Name: 4,5-dimethoxy-2-pyrrol-1-yl-benzonitrile CAS Name: 4,5-dimethoxy-2-(1-pyrrolyl)benzonitrile IUPAC Name: 4,5-dimethoxy-2-pyrrol-1-ylbenzonitrile Traditional Name: 4,5-dimethoxy-2-pyrrol-1-yl-benzonitrile Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C#N)N2C=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C#N)N2C=CC=C2)OC

InChI

InChI=1S/C13H12N2O2/c1-16-12-7-10(9-14)11(8-13(12)17-2)15-5-3-4-6-15/h3-8H,1-2H3