(E)-6-azanyl-5-methyl-6-oxidanylidene-hex-4-ene-3-sulfonic acid

Systemtic Name: (E)-6-azanyl-5-methyl-6-oxidanylidene-hex-4-ene-3-sulfonic acid Openeye Name: (E)-6-amino-5-methyl-6-oxo-hex-4-ene-3-sulfonic acid CAS Name: (E)-6-amino-5-methyl-6-oxo-4-hexene-3-sulfonic acid IUPAC Name: (E)-6-amino-5-methyl-6-oxohex-4-ene-3-sulfonic acid Traditional Name: (E)-6-amino-6-keto-5-methyl-hex-4-ene-3-sulfonic acid Formula: C7H13NO4S MolecularWeight: 207.24742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=C(C)C(=O)N)S(=O)(=O)O

Isomeric SMILES

CCC(/C=C(\C)/C(=O)N)S(=O)(=O)O

InChI

InChI=1S/C7H13NO4S/c1-3-6(13(10,11)12)4-5(2)7(8)9/h4,6H,3H2,1-2H3,(H2,8,9)(H,10,11,12)/b5-4+