(E)-3-bromanyl-4-oxidanylidene-4-(4-pentoxyphenyl)but-2-enoic acid

Systemtic Name: (E)-3-bromanyl-4-oxidanylidene-4-(4-pentoxyphenyl)but-2-enoic acid Openeye Name: (E)-3-bromo-4-oxo-4-(4-pentoxyphenyl)but-2-enoic acid CAS Name: (E)-3-bromo-4-oxo-4-(4-pentoxyphenyl)-2-butenoic acid IUPAC Name: (E)-3-bromo-4-oxo-4-(4-pentoxyphenyl)but-2-enoic acid Traditional Name: (E)-4-(4-amoxyphenyl)-3-bromo-4-keto-but-2-enoic acid Formula: C15H17BrO4 MolecularWeight: 341.19708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)C(=CC(=O)O)Br

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)/C(=C\C(=O)O)/Br

InChI

InChI=1S/C15H17BrO4/c1-2-3-4-9-20-12-7-5-11(6-8-12)15(19)13(16)10-14(17)18/h5-8,10H,2-4,9H2,1H3,(H,17,18)/b13-10+