O4-tert-butyl O1-ethyl (2E)-2-[(2-bromanyl-5-propan-2-yloxy-phenyl)methylidene]butanedioate

Systemtic Name: O4-tert-butyl O1-ethyl (2E)-2-[(2-bromanyl-5-propan-2-yloxy-phenyl)methylidene]butanedioate Openeye Name: O4-tert-butyl O1-ethyl (2E)-2-[(2-bromo-5-isopropoxy-phenyl)methylene]butanedioate CAS Name: (2E)-2-[(2-bromo-5-propan-2-yloxyphenyl)methylidene]butanedioic acid O4-tert-butyl ester O1-ethyl ester IUPAC Name: 4-O-tert-butyl 1-O-ethyl (2E)-2-[(2-bromo-5-propan-2-yloxyphenyl)methylidene]butanedioate Traditional Name: (2E)-2-(2-bromo-5-isopropoxy-benzylidene)succinic acid O4-tert-butyl ester O1-ethyl ester Formula: C20H27BrO5 MolecularWeight: 427.32938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(C=CC(=C1)OC(C)C)Br)CC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H27BrO5/c1-7-24-19(23)15(12-18(22)26-20(4,5)6)10-14-11-16(25-13(2)3)8-9-17(14)21/h8-11,13H,7,12H2,1-6H3/b15-10+