methyl 6-[(2-methyl-5-methylsulfanyl-phenyl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(2-methyl-5-methylsulfanyl-phenyl)carbonylamino]hexanoate Openeye Name: methyl 6-[(2-methyl-5-methylsulfanyl-benzoyl)amino]hexanoate CAS Name: 6-[[[2-methyl-5-(methylthio)phenyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(2-methyl-5-methylsulfanylbenzoyl)amino]hexanoate Traditional Name: 6-[[2-methyl-5-(methylthio)benzoyl]amino]hexanoic acid methyl ester Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC)C(=O)NCCCCCC(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)SC)C(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C16H23NO3S/c1-12-8-9-13(21-3)11-14(12)16(19)17-10-6-4-5-7-15(18)20-2/h8-9,11H,4-7,10H2,1-3H3,(H,17,19)