methyl (2E)-2-[(4-bromophenyl)methylidene]but-3-ynoate

Systemtic Name: methyl (2E)-2-[(4-bromophenyl)methylidene]but-3-ynoate Openeye Name: methyl (2E)-2-[(4-bromophenyl)methylene]but-3-ynoate CAS Name: (2E)-2-[(4-bromophenyl)methylidene]-3-butynoic acid methyl ester IUPAC Name: methyl (2E)-2-[(4-bromophenyl)methylidene]but-3-ynoate Traditional Name: (2E)-2-(4-bromobenzylidene)but-3-ynoic acid methyl ester Formula: C12H9BrO2 MolecularWeight: 265.10266

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=C(C=C1)Br)C#C

Isomeric SMILES

COC(=O)/C(=C/C1=CC=C(C=C1)Br)/C#C

InChI

InChI=1S/C12H9BrO2/c1-3-10(12(14)15-2)8-9-4-6-11(13)7-5-9/h1,4-8H,2H3/b10-8+