dimethyl 5-[3-(2-chloranylethanoyl)-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-(2-chloranylethanoyl)-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-(2-chloroacetyl)-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate CAS Name: 5-[3-(2-chloro-1-oxoethyl)-2,5-dimethyl-1-pyrrolyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-(2-chloroacetyl)-2,5-dimethylpyrrol-1-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(2-chloroacetyl)-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H18ClNO5 MolecularWeight: 363.79222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)C(=O)CCl

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)C(=O)CCl

InChI

InChI=1S/C18H18ClNO5/c1-10-5-15(16(21)9-19)11(2)20(10)14-7-12(17(22)24-3)6-13(8-14)18(23)25-4/h5-8H,9H2,1-4H3