ethyl 5-(chloromethyl)-4-ethanoyl-3-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 5-(chloromethyl)-4-ethanoyl-3-methyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-acetyl-5-(chloromethyl)-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-5-(chloromethyl)-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-5-(chloromethyl)-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-5-(chloromethyl)-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C11H14ClNO3 MolecularWeight: 243.68676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)CCl)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)CCl)C(=O)C)C

InChI

InChI=1S/C11H14ClNO3/c1-4-16-11(15)10-6(2)9(7(3)14)8(5-12)13-10/h13H,4-5H2,1-3H3