methyl 4-(2-chloranylethanoyl)-2,5-dimethyl-1-propan-2-yl-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(2-chloranylethanoyl)-2,5-dimethyl-1-propan-2-yl-pyrrole-3-carboxylate Openeye Name: methyl 4-(2-chloroacetyl)-1-isopropyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 4-(2-chloro-1-oxoethyl)-2,5-dimethyl-1-propan-2-yl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-chloroacetyl)-2,5-dimethyl-1-propan-2-ylpyrrole-3-carboxylate Traditional Name: 4-(2-chloroacetyl)-1-isopropyl-2,5-dimethyl-pyrrole-3-carboxylic acid methyl ester Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C(C)C)C)C(=O)OC)C(=O)CCl

Isomeric SMILES

CC1=C(C(=C(N1C(C)C)C)C(=O)OC)C(=O)CCl

InChI

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