2-[1-ethyl-5-(2,4,6-trimethylphenyl)carbonyl-pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[1-ethyl-5-(2,4,6-trimethylphenyl)carbonyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[1-ethyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetonitrile CAS Name: 2-[1-ethyl-5-[oxo-(2,4,6-trimethylphenyl)methyl]-2-pyrrolyl]acetonitrile IUPAC Name: 2-[1-ethyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetonitrile Traditional Name: 2-[1-ethyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetonitrile Formula: C18H20N2O MolecularWeight: 280.3642

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C1C(=O)C2=C(C=C(C=C2C)C)C)CC#N

Isomeric SMILES

CCN1C(=CC=C1C(=O)C2=C(C=C(C=C2C)C)C)CC#N

InChI

InChI=1S/C18H20N2O/c1-5-20-15(8-9-19)6-7-16(20)18(21)17-13(3)10-12(2)11-14(17)4/h6-7,10-11H,5,8H2,1-4H3