sodium (Z)-2-hexylbut-2-enedioate

Systemtic Name: sodium (Z)-2-hexylbut-2-enedioate Openeye Name: sodium (Z)-2-hexylbut-2-enedioate CAS Name: sodium (Z)-2-hexyl-2-butenedioate IUPAC Name: sodium (Z)-2-hexylbut-2-enedioate Traditional Name: sodium (Z)-2-hexylbut-2-enedioate Formula: C10H14NaO4- MolecularWeight: 221.20553

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=CC(=O)[O-])C(=O)[O-].[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C10H16O4.Na/c1-2-3-4-5-6-8(10(13)14)7-9(11)12;/h7H,2-6H2,1H3,(H,11,12)(H,13,14);/q;+1/p-2/b8-7-;