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

Systemtic Name: 2-[4-chloranyl-1-propan-2-yl-5-(2,4,6-trimethylphenyl)carbonyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[4-chloro-1-isopropyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetonitrile CAS Name: 2-[4-chloro-5-[oxo-(2,4,6-trimethylphenyl)methyl]-1-propan-2-yl-2-pyrrolyl]acetonitrile IUPAC Name: 2-[4-chloro-1-propan-2-yl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetonitrile Traditional Name: 2-[4-chloro-1-isopropyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetonitrile Formula: C19H21ClN2O MolecularWeight: 328.83584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)C2=C(C=C(N2C(C)C)CC#N)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)C2=C(C=C(N2C(C)C)CC#N)Cl)C

InChI

InChI=1S/C19H21ClN2O/c1-11(2)22-15(6-7-21)10-16(20)18(22)19(23)17-13(4)8-12(3)9-14(17)5/h8-11H,6H2,1-5H3