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

Systemtic Name: ethyl (2E)-2-[(3-bromophenyl)methylidene]but-3-ynoate Openeye Name: ethyl (2E)-2-[(3-bromophenyl)methylene]but-3-ynoate CAS Name: (2E)-2-[(3-bromophenyl)methylidene]-3-butynoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[(3-bromophenyl)methylidene]but-3-ynoate Traditional Name: (2E)-2-(3-bromobenzylidene)but-3-ynoic acid ethyl ester Formula: C13H11BrO2 MolecularWeight: 279.12924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11BrO2/c1-3-11(13(15)16-4-2)8-10-6-5-7-12(14)9-10/h1,5-9H,4H2,2H3/b11-8+