sodium (Z)-2-hexadecylbut-2-enedioate

Systemtic Name: sodium (Z)-2-hexadecylbut-2-enedioate Openeye Name: sodium (Z)-2-hexadecylbut-2-enedioate CAS Name: sodium (Z)-2-hexadecyl-2-butenedioate IUPAC Name: sodium (Z)-2-hexadecylbut-2-enedioate Traditional Name: sodium (Z)-2-cetylbut-2-enedioate Formula: C20H34NaO4- MolecularWeight: 361.47133

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H36O4.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20(23)24)17-19(21)22;/h17H,2-16H2,1H3,(H,21,22)(H,23,24);/q;+1/p-2/b18-17-;