(E)-3-ethoxycarbonylundec-3-en-5-ynoic acid

Systemtic Name: (E)-3-ethoxycarbonylundec-3-en-5-ynoic acid Openeye Name: (E)-3-ethoxycarbonylundec-3-en-5-ynoic acid CAS Name: (E)-3-ethoxycarbonylundec-3-en-5-ynoic acid IUPAC Name: (E)-3-ethoxycarbonylundec-3-en-5-ynoic acid Traditional Name: (E)-3-carbethoxyundec-3-en-5-ynoic acid Formula: C14H20O4 MolecularWeight: 252.3062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC=C(CC(=O)O)C(=O)OCC

Isomeric SMILES

CCCCCC#C/C=C(\CC(=O)O)/C(=O)OCC

InChI

InChI=1S/C14H20O4/c1-3-5-6-7-8-9-10-12(11-13(15)16)14(17)18-4-2/h10H,3-7,11H2,1-2H3,(H,15,16)/b12-10+