2-[(S)-cyano-(5-methanoyl-1-methyl-pyrrol-2-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(S)-cyano-(5-methanoyl-1-methyl-pyrrol-2-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(S)-cyano-(5-formyl-1-methyl-pyrrol-2-yl)methyl]benzonitrile CAS Name: 2-[(S)-cyano-(5-formyl-1-methyl-2-pyrrolyl)methyl]benzonitrile IUPAC Name: 2-[(S)-cyano-(5-formyl-1-methylpyrrol-2-yl)methyl]benzonitrile Traditional Name: 2-[(S)-cyano-(5-formyl-1-methyl-pyrrol-2-yl)methyl]benzonitrile Formula: C15H11N3O MolecularWeight: 249.26734

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(C#N)C2=CC=CC=C2C#N)C=O

Isomeric SMILES

CN1C(=CC=C1[C@@H](C#N)C2=CC=CC=C2C#N)C=O

InChI

InChI=1S/C15H11N3O/c1-18-12(10-19)6-7-15(18)14(9-17)13-5-3-2-4-11(13)8-16/h2-7,10,14H,1H3/t14-/m0/s1