2-[1-ethyl-5-(4-methoxyphenyl)carbonyl-pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[1-ethyl-5-(4-methoxyphenyl)carbonyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[1-ethyl-5-(4-methoxybenzoyl)pyrrol-2-yl]acetonitrile CAS Name: 2-[1-ethyl-5-[(4-methoxyphenyl)-oxomethyl]-2-pyrrolyl]acetonitrile IUPAC Name: 2-[1-ethyl-5-(4-methoxybenzoyl)pyrrol-2-yl]acetonitrile Traditional Name: 2-(1-ethyl-5-p-anisoyl-pyrrol-2-yl)acetonitrile Formula: C16H16N2O2 MolecularWeight: 268.31044

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C1C(=O)C2=CC=C(C=C2)OC)CC#N

Isomeric SMILES

CCN1C(=CC=C1C(=O)C2=CC=C(C=C2)OC)CC#N

InChI

InChI=1S/C16H16N2O2/c1-3-18-13(10-11-17)6-9-15(18)16(19)12-4-7-14(20-2)8-5-12/h4-9H,3,10H2,1-2H3