(E)-2-bromanyl-3-methyl-non-2-en-4-ynoic acid

Systemtic Name: (E)-2-bromanyl-3-methyl-non-2-en-4-ynoic acid Openeye Name: (E)-2-bromo-3-methyl-non-2-en-4-ynoic acid CAS Name: (E)-2-bromo-3-methylnon-2-en-4-ynoic acid IUPAC Name: (E)-2-bromo-3-methylnon-2-en-4-ynoic acid Traditional Name: (E)-2-bromo-3-methyl-non-2-en-4-ynoic acid Formula: C10H13BrO2 MolecularWeight: 245.11302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(=C(C(=O)O)Br)C

Isomeric SMILES

CCCCC#C/C(=C(\C(=O)O)/Br)/C

InChI

InChI=1S/C10H13BrO2/c1-3-4-5-6-7-8(2)9(11)10(12)13/h3-5H2,1-2H3,(H,12,13)/b9-8+