magnesium 3-benzamidopropane-1-sulfonate

Systemtic Name: magnesium 3-benzamidopropane-1-sulfonate Openeye Name: magnesium 3-benzamidopropane-1-sulfonate CAS Name: magnesium 3-benzamido-1-propanesulfonate IUPAC Name: magnesium 3-benzamidopropane-1-sulfonate Traditional Name: magnesium 3-benzamidopropane-1-sulfonate Formula: C20H24MgN2O8S2 MolecularWeight: 508.84816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCCS(=O)(=O)[O-].C1=CC=C(C=C1)C(=O)NCCCS(=O)(=O)[O-].[Mg+2]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCCS(=O)(=O)[O-].C1=CC=C(C=C1)C(=O)NCCCS(=O)(=O)[O-].[Mg+2]

InChI

InChI=1S/2C10H13NO4S.Mg/c2*12-10(9-5-2-1-3-6-9)11-7-4-8-16(13,14)15;/h2*1-3,5-6H,4,7-8H2,(H,11,12)(H,13,14,15);/q;;+2/p-2