2-[4-(methoxycarbonylamino)phenyl]-2-phenylsulfanyl-propanoic acid

Systemtic Name: 2-[4-(methoxycarbonylamino)phenyl]-2-phenylsulfanyl-propanoic acid Openeye Name: 2-[4-(methoxycarbonylamino)phenyl]-2-phenylsulfanyl-propanoic acid CAS Name: 2-[4-(methoxycarbonylamino)phenyl]-2-(phenylthio)propanoic acid IUPAC Name: 2-[4-(methoxycarbonylamino)phenyl]-2-phenylsulfanylpropanoic acid Traditional Name: 2-[4-(carbomethoxyamino)phenyl]-2-(phenylthio)propionic acid Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)OC)(C(=O)O)SC2=CC=CC=C2

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)OC)(C(=O)O)SC2=CC=CC=C2

InChI

InChI=1S/C17H17NO4S/c1-17(15(19)20,23-14-6-4-3-5-7-14)12-8-10-13(11-9-12)18-16(21)22-2/h3-11H,1-2H3,(H,18,21)(H,19,20)