sodium 2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]benzenesulfonate

Systemtic Name: sodium 2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]benzenesulfonate Openeye Name: sodium 2-[(E)-3-methoxy-3-oxo-prop-1-enyl]benzenesulfonate CAS Name: sodium 2-[(E)-3-methoxy-3-oxoprop-1-enyl]benzenesulfonate IUPAC Name: sodium 2-[(E)-3-methoxy-3-oxoprop-1-enyl]benzenesulfonate Traditional Name: sodium 2-[(E)-3-keto-3-methoxy-prop-1-enyl]besylate Formula: C10H9NaO5S MolecularWeight: 264.23023

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=CC=C1S(=O)(=O)[O-].[Na+]

Isomeric SMILES

COC(=O)/C=C/C1=CC=CC=C1S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H10O5S.Na/c1-15-10(11)7-6-8-4-2-3-5-9(8)16(12,13)14;/h2-7H,1H3,(H,12,13,14);/q;+1/p-1/b7-6+;