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

Systemtic Name: 2-[4-bromanyl-1-ethyl-5-(2,4,6-trimethylphenyl)carbonyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[4-bromo-1-ethyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetonitrile CAS Name: 2-[4-bromo-1-ethyl-5-[oxo-(2,4,6-trimethylphenyl)methyl]-2-pyrrolyl]acetonitrile IUPAC Name: 2-[4-bromo-1-ethyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetonitrile Traditional Name: 2-[4-bromo-1-ethyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetonitrile Formula: C18H19BrN2O MolecularWeight: 359.26026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrN2O/c1-5-21-14(6-7-20)10-15(19)17(21)18(22)16-12(3)8-11(2)9-13(16)4/h8-10H,5-6H2,1-4H3