O1-tert-butyl O2-ethyl 4-chloranyl-5-ethyl-benzene-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-ethyl 4-chloranyl-5-ethyl-benzene-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-ethyl 4-chloro-5-ethyl-benzene-1,2-dicarboxylate CAS Name: 4-chloro-5-ethylbenzene-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester IUPAC Name: 1-O-tert-butyl 2-O-ethyl 4-chloro-5-ethylbenzene-1,2-dicarboxylate Traditional Name: 4-chloro-5-ethyl-benzene-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester Formula: C16H21ClO4 MolecularWeight: 312.78854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)OC(C)(C)C)C(=O)OCC)Cl

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)OC(C)(C)C)C(=O)OCC)Cl

InChI

InChI=1S/C16H21ClO4/c1-6-10-8-11(15(19)21-16(3,4)5)12(9-13(10)17)14(18)20-7-2/h8-9H,6-7H2,1-5H3