O1-ethyl O5-methyl (Z)-2-[chloranyl(phenyl)methyl]-4,4-dimethyl-pent-2-enedioate

Systemtic Name: O1-ethyl O5-methyl (Z)-2-[chloranyl(phenyl)methyl]-4,4-dimethyl-pent-2-enedioate Openeye Name: O1-ethyl O5-methyl (Z)-2-[chloro(phenyl)methyl]-4,4-dimethyl-pent-2-enedioate CAS Name: (Z)-2-[chloro(phenyl)methyl]-4,4-dimethyl-2-pentenedioic acid O1-ethyl ester O5-methyl ester IUPAC Name: 1-O-ethyl 5-O-methyl (Z)-2-[chloro(phenyl)methyl]-4,4-dimethylpent-2-enedioate Traditional Name: (Z)-2-[chloro(phenyl)methyl]-4,4-dimethyl-pent-2-enedioic acid O1-ethyl ester O5-methyl ester Formula: C17H21ClO4 MolecularWeight: 324.79924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21ClO4/c1-5-22-15(19)13(11-17(2,3)16(20)21-4)14(18)12-9-7-6-8-10-12/h6-11,14H,5H2,1-4H3/b13-11+