O4-tert-butyl O1-ethyl 3-(4-chlorophenyl)carbonyl-2-ethanoyl-butanedioate

Systemtic Name: O4-tert-butyl O1-ethyl 3-(4-chlorophenyl)carbonyl-2-ethanoyl-butanedioate Openeye Name: O1-tert-butyl O4-ethyl 3-acetyl-2-(4-chlorobenzoyl)butanedioate CAS Name: 2-acetyl-3-[(4-chlorophenyl)-oxomethyl]butanedioic acid O4-tert-butyl ester O1-ethyl ester IUPAC Name: 4-O-tert-butyl 1-O-ethyl 2-acetyl-3-(4-chlorobenzoyl)butanedioate Traditional Name: 3-acetyl-2-(4-chlorobenzoyl)succinic acid O1-tert-butyl ester O4-ethyl ester Formula: C19H23ClO6 MolecularWeight: 382.83532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(=O)C1=CC=C(C=C1)Cl)C(=O)OC(C)(C)C)C(=O)C

Isomeric SMILES

CCOC(=O)C(C(C(=O)C1=CC=C(C=C1)Cl)C(=O)OC(C)(C)C)C(=O)C

InChI

InChI=1S/C19H23ClO6/c1-6-25-17(23)14(11(2)21)15(18(24)26-19(3,4)5)16(22)12-7-9-13(20)10-8-12/h7-10,14-15H,6H2,1-5H3