diethyl 2-[(4-chlorophenyl)methyl]-2-propan-2-yl-propanedioate

Systemtic Name: diethyl 2-[(4-chlorophenyl)methyl]-2-propan-2-yl-propanedioate Openeye Name: diethyl 2-[(4-chlorophenyl)methyl]-2-isopropyl-propanedioate CAS Name: 2-[(4-chlorophenyl)methyl]-2-propan-2-ylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(4-chlorophenyl)methyl]-2-propan-2-ylpropanedioate Traditional Name: 2-(4-chlorobenzyl)-2-isopropyl-malonic acid diethyl ester Formula: C17H23ClO4 MolecularWeight: 326.81512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)Cl)(C(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)Cl)(C(C)C)C(=O)OCC

InChI

InChI=1S/C17H23ClO4/c1-5-21-15(19)17(12(3)4,16(20)22-6-2)11-13-7-9-14(18)10-8-13/h7-10,12H,5-6,11H2,1-4H3