ethyl 4-[(4-chlorophenyl)methyl]-5-ethyl-5-methyl-2-oxidanylidene-furan-3-carboxylate

Systemtic Name: ethyl 4-[(4-chlorophenyl)methyl]-5-ethyl-5-methyl-2-oxidanylidene-furan-3-carboxylate Openeye Name: ethyl 4-[(4-chlorophenyl)methyl]-5-ethyl-5-methyl-2-oxo-furan-3-carboxylate CAS Name: 4-[(4-chlorophenyl)methyl]-5-ethyl-5-methyl-2-oxo-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-chlorophenyl)methyl]-5-ethyl-5-methyl-2-oxofuran-3-carboxylate Traditional Name: 4-(4-chlorobenzyl)-5-ethyl-2-keto-5-methyl-furan-3-carboxylic acid ethyl ester Formula: C17H19ClO4 MolecularWeight: 322.78336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=C(C(=O)O1)C(=O)OCC)CC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCC1(C(=C(C(=O)O1)C(=O)OCC)CC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C17H19ClO4/c1-4-17(3)13(10-11-6-8-12(18)9-7-11)14(16(20)22-17)15(19)21-5-2/h6-9H,4-5,10H2,1-3H3