[4-bromanyl-2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]phenyl] but-2-ynoate

Systemtic Name: [4-bromanyl-2-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]phenyl] but-2-ynoate Openeye Name: [4-bromo-2-[(E)-3-ethoxy-3-oxo-prop-1-enyl]phenyl] but-2-ynoate CAS Name: 2-butynoic acid [4-bromo-2-[(E)-3-ethoxy-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-3-ethoxy-3-oxoprop-1-enyl]phenyl] but-2-ynoate Traditional Name: but-2-ynoic acid [4-bromo-2-[(E)-3-ethoxy-3-keto-prop-1-enyl]phenyl] ester Formula: C15H13BrO4 MolecularWeight: 337.16532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13BrO4/c1-3-5-15(18)20-13-8-7-12(16)10-11(13)6-9-14(17)19-4-2/h6-10H,4H2,1-2H3/b9-6+