(Z)-4-(6-methylheptoxy)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-(6-methylheptoxy)-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-(6-methylheptoxy)-4-oxo-but-2-enoic acid CAS Name: (Z)-4-(6-methylheptoxy)-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-(6-methylheptoxy)-4-oxobut-2-enoic acid Traditional Name: (Z)-4-keto-4-(6-methylheptoxy)but-2-enoic acid Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOC(=O)C=CC(=O)O

Isomeric SMILES

CC(C)CCCCCOC(=O)/C=C\C(=O)O

InChI

InChI=1S/C12H20O4/c1-10(2)6-4-3-5-9-16-12(15)8-7-11(13)14/h7-8,10H,3-6,9H2,1-2H3,(H,13,14)/b8-7-