2-[5-(phenylcarbonyl)-1-(phenylmethyl)pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[5-(phenylcarbonyl)-1-(phenylmethyl)pyrrol-2-yl]ethanenitrile Openeye Name: 2-(5-benzoyl-1-benzyl-pyrrol-2-yl)acetonitrile CAS Name: 2-[5-benzoyl-1-(phenylmethyl)-2-pyrrolyl]acetonitrile IUPAC Name: 2-(5-benzoyl-1-benzylpyrrol-2-yl)acetonitrile Traditional Name: 2-(5-benzoyl-1-benzyl-pyrrol-2-yl)acetonitrile Formula: C20H16N2O MolecularWeight: 300.35384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC=C2C(=O)C3=CC=CC=C3)CC#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC=C2C(=O)C3=CC=CC=C3)CC#N

InChI

InChI=1S/C20H16N2O/c21-14-13-18-11-12-19(20(23)17-9-5-2-6-10-17)22(18)15-16-7-3-1-4-8-16/h1-12H,13,15H2