ethyl 2-[(3-chloranyl-4-methoxy-2,6-dimethyl-phenyl)methyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[(3-chloranyl-4-methoxy-2,6-dimethyl-phenyl)methyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(3-chloro-4-methoxy-2,6-dimethyl-phenyl)methyl]-3-oxo-butanoate CAS Name: 2-[(3-chloro-4-methoxy-2,6-dimethylphenyl)methyl]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(3-chloro-4-methoxy-2,6-dimethylphenyl)methyl]-3-oxobutanoate Traditional Name: 2-(3-chloro-4-methoxy-2,6-dimethyl-benzyl)-3-keto-butyric acid ethyl ester Formula: C16H21ClO4 MolecularWeight: 312.78854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C(=C(C=C1C)OC)Cl)C)C(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=C(C(=C(C=C1C)OC)Cl)C)C(=O)C

InChI

InChI=1S/C16H21ClO4/c1-6-21-16(19)13(11(4)18)8-12-9(2)7-14(20-5)15(17)10(12)3/h7,13H,6,8H2,1-5H3