sodium 2-(2,4-dimethylphenoxy)-N-(4-sulfinatophenyl)butanamide

Systemtic Name: sodium 2-(2,4-dimethylphenoxy)-N-(4-sulfinatophenyl)butanamide Openeye Name: sodium 2-(2,4-dimethylphenoxy)-N-(4-sulfinatophenyl)butanamide CAS Name: sodium 2-(2,4-dimethylphenoxy)-N-(4-sulfinatophenyl)butanamide IUPAC Name: sodium 2-(2,4-dimethylphenoxy)-N-(4-sulfinatophenyl)butanamide Traditional Name: sodium 2-(2,4-dimethylphenoxy)-N-(4-sulfinatophenyl)butyramide Formula: C18H20NNaO4S MolecularWeight: 369.41047

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)[S-](=O)=O)OC2=C(C=C(C=C2)C)C.[Na+]

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)[S-](=O)=O)OC2=C(C=C(C=C2)C)C.[Na+]

InChI

InChI=1S/C18H20NO4S.Na/c1-4-16(23-17-10-5-12(2)11-13(17)3)18(20)19-14-6-8-15(9-7-14)24(21)22;/h5-11,16H,4H2,1-3H3,(H,19,20);/q-1;+1