[[6-(methylamino)-6-oxidanylidene-hexanoyl]amino] 3-chloranylbenzenesulfinate

Systemtic Name: [[6-(methylamino)-6-oxidanylidene-hexanoyl]amino] 3-chloranylbenzenesulfinate Openeye Name: [[6-(methylamino)-6-oxo-hexanoyl]amino] 3-chlorobenzenesulfinate CAS Name: 3-chlorobenzenesulfinic acid [[6-(methylamino)-1,6-dioxohexyl]amino] ester IUPAC Name: [[6-(methylamino)-6-oxohexanoyl]amino] 3-chlorobenzenesulfinate Traditional Name: 3-chlorobenzenesulfinic acid [[6-keto-6-(methylamino)hexanoyl]amino] ester Formula: C13H17ClN2O4S MolecularWeight: 332.80308

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCCCC(=O)NOS(=O)C1=CC(=CC=C1)Cl

Isomeric SMILES

CNC(=O)CCCCC(=O)NOS(=O)C1=CC(=CC=C1)Cl

InChI

InChI=1S/C13H17ClN2O4S/c1-15-12(17)7-2-3-8-13(18)16-20-21(19)11-6-4-5-10(14)9-11/h4-6,9H,2-3,7-8H2,1H3,(H,15,17)(H,16,18)