sodium 4-(prop-2-enoylamino)butoxy 2-methoxybenzenesulfonate

Systemtic Name: sodium 4-(prop-2-enoylamino)butoxy 2-methoxybenzenesulfonate Openeye Name: sodium 4-(prop-2-enoylamino)butoxy 2-methoxybenzenesulfonate CAS Name: sodium 2-methoxybenzenesulfonic acid 4-(1-oxoprop-2-enylamino)butoxy ester IUPAC Name: sodium 4-(prop-2-enoylamino)butoxy 2-methoxybenzenesulfonate Traditional Name: sodium 2-methoxybenzenesulfonic acid 4-acrylamidobutoxy ester Formula: C14H19NNaO6S+ MolecularWeight: 352.35853

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1S(=O)(=O)OOCCCCNC(=O)C=C.[Na+]

Isomeric SMILES

COC1=CC=CC=C1S(=O)(=O)OOCCCCNC(=O)C=C.[Na+]

InChI

InChI=1S/C14H19NO6S.Na/c1-3-14(16)15-10-6-7-11-20-21-22(17,18)13-9-5-4-8-12(13)19-2;/h3-5,8-9H,1,6-7,10-11H2,2H3,(H,15,16);/q;+1