2-ethyl-2-sulfo-butanedioic acid; (E)-undec-2-enamide

Systemtic Name: 2-ethyl-2-sulfo-butanedioic acid; (E)-undec-2-enamide Openeye Name: 2-ethyl-2-sulfo-butanedioic acid; (E)-undec-2-enamide CAS Name: 2-ethyl-2-sulfobutanedioic acid; (E)-2-undecenamide IUPAC Name: 2-ethyl-2-sulfobutanedioic acid; (E)-undec-2-enamide Traditional Name: 2-ethyl-2-sulfo-succinic acid; (E)-undec-2-enamide Formula: C17H31NO8S MolecularWeight: 409.49494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CC(=O)N.CCC(CC(=O)O)(C(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC/C=C/C(=O)N.CCC(CC(=O)O)(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C11H21NO.C6H10O7S/c1-2-3-4-5-6-7-8-9-10-11(12)13;1-2-6(5(9)10,3-4(7)8)14(11,12)13/h9-10H,2-8H2,1H3,(H2,12,13);2-3H2,1H3,(H,7,8)(H,9,10)(H,11,12,13)/b10-9+;