2-[[3-(methoxymethyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[3-(methoxymethyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[3-(methoxymethyl)benzoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[[3-(methoxymethyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[3-(methoxymethyl)benzoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[3-(methoxymethyl)benzoyl]amino]-4-(methylthio)butyric acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

COCC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C14H19NO4S/c1-19-9-10-4-3-5-11(8-10)13(16)15-12(14(17)18)6-7-20-2/h3-5,8,12H,6-7,9H2,1-2H3,(H,15,16)(H,17,18)