sodium; hexane; 2-methylprop-2-enoate; (E)-2-phenylethenesulfonic acid

Systemtic Name: sodium; hexane; 2-methylprop-2-enoate; (E)-2-phenylethenesulfonic acid Openeye Name: sodium; hexane; 2-methylprop-2-enoate; (E)-2-phenylethenesulfonic acid CAS Name: sodium; hexane; 2-methyl-2-propenoate; (E)-2-phenylethenesulfonic acid IUPAC Name: sodium; hexane; 2-methylprop-2-enoate; (E)-2-phenylethenesulfonic acid Traditional Name: sodium; hexane; methacrylate; (E)-2-phenylethenesulfonic acid Formula: C18H26NaO5S- MolecularWeight: 377.45081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[CH2-].CC(=C)C(=O)[O-].C1=CC=C(C=C1)C=CS(=O)(=O)O.[Na+]

Isomeric SMILES

CCCCC[CH2-].CC(=C)C(=O)[O-].C1=CC=C(C=C1)/C=C/S(=O)(=O)O.[Na+]

InChI

InChI=1S/C8H8O3S.C6H13.C4H6O2.Na/c9-12(10,11)7-6-8-4-2-1-3-5-8;1-3-5-6-4-2;1-3(2)4(5)6;/h1-7H,(H,9,10,11);1,3-6H2,2H3;1H2,2H3,(H,5,6);/q;-1;;+1/p-1/b7-6+;;;