methyl 4-[3-(2-chloranylethanoyl)-2,5-dimethyl-pyrrol-1-yl]butanoate

Systemtic Name: methyl 4-[3-(2-chloranylethanoyl)-2,5-dimethyl-pyrrol-1-yl]butanoate Openeye Name: methyl 4-[3-(2-chloroacetyl)-2,5-dimethyl-pyrrol-1-yl]butanoate CAS Name: 4-[3-(2-chloro-1-oxoethyl)-2,5-dimethyl-1-pyrrolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[3-(2-chloroacetyl)-2,5-dimethylpyrrol-1-yl]butanoate Traditional Name: 4-[3-(2-chloroacetyl)-2,5-dimethyl-pyrrol-1-yl]butyric acid methyl ester Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCCC(=O)OC)C)C(=O)CCl

Isomeric SMILES

CC1=CC(=C(N1CCCC(=O)OC)C)C(=O)CCl

InChI

InChI=1S/C13H18ClNO3/c1-9-7-11(12(16)8-14)10(2)15(9)6-4-5-13(17)18-3/h7H,4-6,8H2,1-3H3