disodium (Z)-2-methylhept-2-enoate

Systemtic Name: disodium (Z)-2-methylhept-2-enoate Openeye Name: disodium (Z)-2-methylhept-2-enoate CAS Name: disodium (Z)-2-methyl-2-heptenoate IUPAC Name: disodium (Z)-2-methylhept-2-enoate Traditional Name: disodium (Z)-2-methylhept-2-enoate Formula: C16H26Na2O4 MolecularWeight: 328.35478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=C(C)C(=O)[O-].CCCCC=C(C)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCC/C=C(\C(=O)[O-])/C.CCCC/C=C(\C(=O)[O-])/C.[Na+].[Na+]

InChI

InChI=1S/2C8H14O2.2Na/c2*1-3-4-5-6-7(2)8(9)10;;/h2*6H,3-5H2,1-2H3,(H,9,10);;/q;;2*+1/p-2/b2*7-6-;;