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

Systemtic Name: methyl 4-[3-(2-chloranylethanoyl)-2,5-dimethyl-pyrrol-1-yl]benzoate Openeye Name: methyl 4-[3-(2-chloroacetyl)-2,5-dimethyl-pyrrol-1-yl]benzoate CAS Name: 4-[3-(2-chloro-1-oxoethyl)-2,5-dimethyl-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(2-chloroacetyl)-2,5-dimethylpyrrol-1-yl]benzoate Traditional Name: 4-[3-(2-chloroacetyl)-2,5-dimethyl-pyrrol-1-yl]benzoic acid methyl ester Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClNO3/c1-10-8-14(15(19)9-17)11(2)18(10)13-6-4-12(5-7-13)16(20)21-3/h4-8H,9H2,1-3H3