(2-azanylpropanoylamino) (E)-5-methylhex-1-ene-1-sulfonate

Systemtic Name: (2-azanylpropanoylamino) (E)-5-methylhex-1-ene-1-sulfonate Openeye Name: (2-aminopropanoylamino) (E)-5-methylhex-1-ene-1-sulfonate CAS Name: (E)-5-methyl-1-hexene-1-sulfonic acid [(2-amino-1-oxopropyl)amino] ester IUPAC Name: (2-aminopropanoylamino) (E)-5-methylhex-1-ene-1-sulfonate Traditional Name: (E)-5-methylhex-1-ene-1-sulfonic acid (alanylamino) ester Formula: C10H20N2O4S MolecularWeight: 264.3418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC=CS(=O)(=O)ONC(=O)C(C)N

Isomeric SMILES

CC(C)CC/C=C/S(=O)(=O)ONC(=O)C(C)N

InChI

InChI=1S/C10H20N2O4S/c1-8(2)6-4-5-7-17(14,15)16-12-10(13)9(3)11/h5,7-9H,4,6,11H2,1-3H3,(H,12,13)/b7-5+