2-[5-(4-ethoxyphenyl)carbonyl-1-(phenylmethyl)pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[5-(4-ethoxyphenyl)carbonyl-1-(phenylmethyl)pyrrol-2-yl]ethanenitrile Openeye Name: 2-[1-benzyl-5-(4-ethoxybenzoyl)pyrrol-2-yl]acetonitrile CAS Name: 2-[5-[(4-ethoxyphenyl)-oxomethyl]-1-(phenylmethyl)-2-pyrrolyl]acetonitrile IUPAC Name: 2-[1-benzyl-5-(4-ethoxybenzoyl)pyrrol-2-yl]acetonitrile Traditional Name: 2-[1-benzyl-5-(4-ethoxybenzoyl)pyrrol-2-yl]acetonitrile Formula: C22H20N2O2 MolecularWeight: 344.4064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C2=CC=C(N2CC3=CC=CC=C3)CC#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C2=CC=C(N2CC3=CC=CC=C3)CC#N

InChI

InChI=1S/C22H20N2O2/c1-2-26-20-11-8-18(9-12-20)22(25)21-13-10-19(14-15-23)24(21)16-17-6-4-3-5-7-17/h3-13H,2,14,16H2,1H3