(2R)-2-[3-(4-methylphenyl)sulfanylpropanoylamino]butanedioate

Systemtic Name: (2R)-2-[3-(4-methylphenyl)sulfanylpropanoylamino]butanedioate Openeye Name: (2R)-2-[3-(p-tolylsulfanyl)propanoylamino]butanedioate CAS Name: (2R)-2-[[3-[(4-methylphenyl)thio]-1-oxopropyl]amino]butanedioate IUPAC Name: (2R)-2-[3-(4-methylphenyl)sulfanylpropanoylamino]butanedioate Traditional Name: (2R)-2-[3-(p-tolylthio)propanoylamino]succinate Formula: C14H15NO5S-2 MolecularWeight: 309.3376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N[C@H](CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H17NO5S/c1-9-2-4-10(5-3-9)21-7-6-12(16)15-11(14(19)20)8-13(17)18/h2-5,11H,6-8H2,1H3,(H,15,16)(H,17,18)(H,19,20)/p-2/t11-/m1/s1