2-hexa-1,5-dien-3-yl-2-sulfo-butanedioate

Systemtic Name: 2-hexa-1,5-dien-3-yl-2-sulfo-butanedioate Openeye Name: 2-sulfo-2-(1-vinylbut-3-enyl)butanedioate CAS Name: 2-hexa-1,5-dien-3-yl-2-sulfobutanedioate IUPAC Name: 2-hexa-1,5-dien-3-yl-2-sulfobutanedioate Traditional Name: 2-sulfo-2-(1-vinylbut-3-enyl)succinate Formula: C10H12O7S-2 MolecularWeight: 276.26308

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C=C)C(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)O

Isomeric SMILES

C=CCC(C=C)C(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C10H14O7S/c1-3-5-7(4-2)10(9(13)14,6-8(11)12)18(15,16)17/h3-4,7H,1-2,5-6H2,(H,11,12)(H,13,14)(H,15,16,17)/p-2