(Z)-2,5-dimethyl-5-(prop-2-enoylamino)-6-sulfo-hex-2-enoic acid

Systemtic Name: (Z)-2,5-dimethyl-5-(prop-2-enoylamino)-6-sulfo-hex-2-enoic acid Openeye Name: (Z)-2,5-dimethyl-5-(prop-2-enoylamino)-6-sulfo-hex-2-enoic acid CAS Name: (Z)-2,5-dimethyl-5-(1-oxoprop-2-enylamino)-6-sulfo-2-hexenoic acid IUPAC Name: (Z)-2,5-dimethyl-5-(prop-2-enoylamino)-6-sulfohex-2-enoic acid Traditional Name: (Z)-5-acrylamido-2,5-dimethyl-6-sulfo-hex-2-enoic acid Formula: C11H17NO6S MolecularWeight: 291.32078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC(C)(CS(=O)(=O)O)NC(=O)C=C)C(=O)O

Isomeric SMILES

C/C(=C/CC(C)(CS(=O)(=O)O)NC(=O)C=C)/C(=O)O

InChI

InChI=1S/C11H17NO6S/c1-4-9(13)12-11(3,7-19(16,17)18)6-5-8(2)10(14)15/h4-5H,1,6-7H2,2-3H3,(H,12,13)(H,14,15)(H,16,17,18)/b8-5-