2-chloranyl-1-(2,5-dimethyl-1-pentan-2-yl-pyrrol-3-yl)propan-1-one

Systemtic Name: 2-chloranyl-1-(2,5-dimethyl-1-pentan-2-yl-pyrrol-3-yl)propan-1-one Openeye Name: 2-chloro-1-[2,5-dimethyl-1-(1-methylbutyl)pyrrol-3-yl]propan-1-one CAS Name: 2-chloro-1-(2,5-dimethyl-1-pentan-2-yl-3-pyrrolyl)-1-propanone IUPAC Name: 2-chloro-1-(2,5-dimethyl-1-pentan-2-ylpyrrol-3-yl)propan-1-one Traditional Name: 2-chloro-1-[2,5-dimethyl-1-(1-methylbutyl)pyrrol-3-yl]propan-1-one Formula: C14H22ClNO MolecularWeight: 255.78358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N1C(=CC(=C1C)C(=O)C(C)Cl)C

Isomeric SMILES

CCCC(C)N1C(=CC(=C1C)C(=O)C(C)Cl)C

InChI

InChI=1S/C14H22ClNO/c1-6-7-9(2)16-10(3)8-13(12(16)5)14(17)11(4)15/h8-9,11H,6-7H2,1-5H3