1-(1-butan-2-yl-2,5-dimethyl-pyrrol-3-yl)-2-chloranyl-ethanone

Systemtic Name: 1-(1-butan-2-yl-2,5-dimethyl-pyrrol-3-yl)-2-chloranyl-ethanone Openeye Name: 2-chloro-1-(2,5-dimethyl-1-sec-butyl-pyrrol-3-yl)ethanone CAS Name: 1-(1-butan-2-yl-2,5-dimethyl-3-pyrrolyl)-2-chloroethanone IUPAC Name: 1-(1-butan-2-yl-2,5-dimethylpyrrol-3-yl)-2-chloroethanone Traditional Name: 2-chloro-1-(2,5-dimethyl-1-sec-butyl-pyrrol-3-yl)ethanone Formula: C12H18ClNO MolecularWeight: 227.73042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=CC(=C1C)C(=O)CCl)C

Isomeric SMILES

CCC(C)N1C(=CC(=C1C)C(=O)CCl)C

InChI

InChI=1S/C12H18ClNO/c1-5-8(2)14-9(3)6-11(10(14)4)12(15)7-13/h6,8H,5,7H2,1-4H3