methyl 2-[3-(2-chloranylpropanoyl)-2,5-dimethyl-pyrrol-1-yl]ethanoate

Systemtic Name: methyl 2-[3-(2-chloranylpropanoyl)-2,5-dimethyl-pyrrol-1-yl]ethanoate Openeye Name: methyl 2-[3-(2-chloropropanoyl)-2,5-dimethyl-pyrrol-1-yl]acetate CAS Name: 2-[3-(2-chloro-1-oxopropyl)-2,5-dimethyl-1-pyrrolyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(2-chloropropanoyl)-2,5-dimethylpyrrol-1-yl]acetate Traditional Name: 2-[3-(2-chloropropanoyl)-2,5-dimethyl-pyrrol-1-yl]acetic acid methyl ester Formula: C12H16ClNO3 MolecularWeight: 257.71334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC(=O)OC)C)C(=O)C(C)Cl

Isomeric SMILES

CC1=CC(=C(N1CC(=O)OC)C)C(=O)C(C)Cl

InChI

InChI=1S/C12H16ClNO3/c1-7-5-10(12(16)8(2)13)9(3)14(7)6-11(15)17-4/h5,8H,6H2,1-4H3