O3-tert-butyl O1-(2-chloroethyl) 2-(1H-pyrrol-2-yl)propanedioate

Systemtic Name: O3-tert-butyl O1-(2-chloroethyl) 2-(1H-pyrrol-2-yl)propanedioate Openeye Name: O1-tert-butyl O3-(2-chloroethyl) 2-(1H-pyrrol-2-yl)propanedioate CAS Name: 2-(1H-pyrrol-2-yl)propanedioic acid O3-tert-butyl ester O1-(2-chloroethyl) ester IUPAC Name: 3-O-tert-butyl 1-O-(2-chloroethyl) 2-(1H-pyrrol-2-yl)propanedioate Traditional Name: 2-(1H-pyrrol-2-yl)malonic acid O1-tert-butyl ester O3-(2-chloroethyl) ester Formula: C13H18ClNO4 MolecularWeight: 287.73932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=CC=CN1)C(=O)OCCCl

Isomeric SMILES

CC(C)(C)OC(=O)C(C1=CC=CN1)C(=O)OCCCl

InChI

InChI=1S/C13H18ClNO4/c1-13(2,3)19-12(17)10(9-5-4-7-15-9)11(16)18-8-6-14/h4-5,7,10,15H,6,8H2,1-3H3