4-[[(1R)-3-methoxy-1-(4-methylsulfanylphenyl)-3-oxidanylidene-propyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[(1R)-3-methoxy-1-(4-methylsulfanylphenyl)-3-oxidanylidene-propyl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[(1R)-3-methoxy-1-(4-methylsulfanylphenyl)-3-oxo-propyl]amino]-4-oxo-butanoate CAS Name: 4-[[(1R)-3-methoxy-1-[4-(methylthio)phenyl]-3-oxopropyl]amino]-4-oxobutanoate IUPAC Name: 4-[[(1R)-3-methoxy-1-(4-methylsulfanylphenyl)-3-oxopropyl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[[(1R)-3-keto-3-methoxy-1-[4-(methylthio)phenyl]propyl]amino]butyrate Formula: C15H18NO5S- MolecularWeight: 324.37212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)SC)NC(=O)CCC(=O)[O-]

Isomeric SMILES

COC(=O)C[C@H](C1=CC=C(C=C1)SC)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C15H19NO5S/c1-21-15(20)9-12(16-13(17)7-8-14(18)19)10-3-5-11(22-2)6-4-10/h3-6,12H,7-9H2,1-2H3,(H,16,17)(H,18,19)/p-1/t12-/m1/s1