2-(ethylsulfanylmethyl)-4-methyl-pentanoic acid

Systemtic Name: 2-(ethylsulfanylmethyl)-4-methyl-pentanoic acid Openeye Name: 2-(ethylsulfanylmethyl)-4-methyl-pentanoic acid CAS Name: 2-[(ethylthio)methyl]-4-methylpentanoic acid IUPAC Name: 2-(ethylsulfanylmethyl)-4-methylpentanoic acid Traditional Name: 2-[(ethylthio)methyl]-4-methyl-valeric acid Formula: C9H18O2S MolecularWeight: 190.30302

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC(CC(C)C)C(=O)O

Isomeric SMILES

CCSCC(CC(C)C)C(=O)O

InChI

InChI=1S/C9H18O2S/c1-4-12-6-8(9(10)11)5-7(2)3/h7-8H,4-6H2,1-3H3,(H,10,11)