methyl 2-[(2,6-dimethylphenyl)-(2-sulfinooxypentanoyl)amino]propanoate

Systemtic Name: methyl 2-[(2,6-dimethylphenyl)-(2-sulfinooxypentanoyl)amino]propanoate Openeye Name: methyl 2-[2,6-dimethyl-N-(2-sulfinooxypentanoyl)anilino]propanoate CAS Name: 2-(2,6-dimethyl-N-(1-oxo-2-sulfinooxypentyl)anilino)propanoic acid methyl ester IUPAC Name: methyl 2-[2,6-dimethyl-N-(2-sulfinooxypentanoyl)anilino]propanoate Traditional Name: 2-[2,6-dimethyl-N-(2-sulfinooxypentanoyl)anilino]propionic acid methyl ester Formula: C17H25NO6S MolecularWeight: 371.4485

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N(C1=C(C=CC=C1C)C)C(C)C(=O)OC)OS(=O)O

Isomeric SMILES

CCCC(C(=O)N(C1=C(C=CC=C1C)C)C(C)C(=O)OC)OS(=O)O

InChI

InChI=1S/C17H25NO6S/c1-6-8-14(24-25(21)22)16(19)18(13(4)17(20)23-5)15-11(2)9-7-10-12(15)3/h7,9-10,13-14H,6,8H2,1-5H3,(H,21,22)