ethyl 1-(2-chloroethyl)-2-(2-ethoxy-2-oxidanylidene-ethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 1-(2-chloroethyl)-2-(2-ethoxy-2-oxidanylidene-ethyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-(2-chloroethyl)-2-(2-ethoxy-2-oxo-ethyl)pyrrole-3-carboxylate CAS Name: 1-(2-chloroethyl)-2-(2-ethoxy-2-oxoethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-chloroethyl)-2-(2-ethoxy-2-oxoethyl)pyrrole-3-carboxylate Traditional Name: 1-(2-chloroethyl)-2-(2-ethoxy-2-keto-ethyl)pyrrole-3-carboxylic acid ethyl ester Formula: C13H18ClNO4 MolecularWeight: 287.73932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C=CN1CCCl)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(C=CN1CCCl)C(=O)OCC

InChI

InChI=1S/C13H18ClNO4/c1-3-18-12(16)9-11-10(13(17)19-4-2)5-7-15(11)8-6-14/h5,7H,3-4,6,8-9H2,1-2H3