(3R)-3-(3-chlorophenyl)-3-[(4-methoxy-2-methylsulfanyl-phenyl)carbonylamino]propanoate

Systemtic Name: (3R)-3-(3-chlorophenyl)-3-[(4-methoxy-2-methylsulfanyl-phenyl)carbonylamino]propanoate Openeye Name: (3R)-3-(3-chlorophenyl)-3-[(4-methoxy-2-methylsulfanyl-benzoyl)amino]propanoate CAS Name: (3R)-3-(3-chlorophenyl)-3-[[[4-methoxy-2-(methylthio)phenyl]-oxomethyl]amino]propanoate IUPAC Name: (3R)-3-(3-chlorophenyl)-3-[(4-methoxy-2-methylsulfanylbenzoyl)amino]propanoate Traditional Name: (3R)-3-(3-chlorophenyl)-3-[[4-methoxy-2-(methylthio)benzoyl]amino]propionate Formula: C18H17ClNO4S- MolecularWeight: 378.84988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)NC(CC(=O)[O-])C2=CC(=CC=C2)Cl)SC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N[C@H](CC(=O)[O-])C2=CC(=CC=C2)Cl)SC

InChI

InChI=1S/C18H18ClNO4S/c1-24-13-6-7-14(16(9-13)25-2)18(23)20-15(10-17(21)22)11-4-3-5-12(19)8-11/h3-9,15H,10H2,1-2H3,(H,20,23)(H,21,22)/p-1/t15-/m1/s1