2-[(4-methylphenyl)methoxycarbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(4-methylphenyl)methoxycarbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 4-methylsulfanyl-2-(p-tolylmethoxycarbonylamino)butanoic acid CAS Name: 2-[[(4-methylphenyl)methoxy-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(4-methylphenyl)methoxycarbonylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(4-methylbenzyl)oxycarbonylamino]-4-(methylthio)butyric acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)NC(CCSC)C(=O)O

InChI

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