2-chloranyl-1-[2,5-dimethyl-1-(3-methylbutan-2-yl)pyrrol-3-yl]propan-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C(C)C)C)C(=O)C(C)Cl

Isomeric SMILES

CC1=CC(=C(N1C(C)C(C)C)C)C(=O)C(C)Cl

InChI

InChI=1S/C14H22ClNO/c1-8(2)11(5)16-9(3)7-13(12(16)6)14(17)10(4)15/h7-8,10-11H,1-6H3