sodium N-[3-(4-chloranyl-3-methyl-phenoxy)-2-oxidanyl-propyl]sulfamate

Systemtic Name: sodium N-[3-(4-chloranyl-3-methyl-phenoxy)-2-oxidanyl-propyl]sulfamate Openeye Name: sodium N-[3-(4-chloro-3-methyl-phenoxy)-2-hydroxy-propyl]sulfamate CAS Name: sodium N-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]sulfamate IUPAC Name: sodium N-[3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]sulfamate Traditional Name: sodium N-[3-(4-chloro-3-methyl-phenoxy)-2-hydroxy-propyl]sulfamate Formula: C10H13ClNNaO5S MolecularWeight: 317.72169

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(CNS(=O)(=O)[O-])O)Cl.[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(CNS(=O)(=O)[O-])O)Cl.[Na+]

InChI

InChI=1S/C10H14ClNO5S.Na/c1-7-4-9(2-3-10(7)11)17-6-8(13)5-12-18(14,15)16;/h2-4,8,12-13H,5-6H2,1H3,(H,14,15,16);/q;+1/p-1