2-[2-methoxy-6-[(phenylmethyl)carbamoyl]phenyl]selanylsulfanylpropanoic acid

Systemtic Name: 2-[2-methoxy-6-[(phenylmethyl)carbamoyl]phenyl]selanylsulfanylpropanoic acid Openeye Name: 2-[2-(benzylcarbamoyl)-6-methoxy-phenyl]selanylsulfanylpropanoic acid CAS Name: 2-[[[2-methoxy-6-[oxo-[(phenylmethyl)amino]methyl]phenyl]seleno]thio]propanoic acid IUPAC Name: 2-[2-(benzylcarbamoyl)-6-methoxyphenyl]selanylsulfanylpropanoic acid Traditional Name: 2-[[[2-(benzylcarbamoyl)-6-methoxy-phenyl]seleno]thio]propionic acid Formula: C18H19NO4SSe MolecularWeight: 424.37276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S[Se]C1=C(C=CC=C1OC)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)O)S[Se]C1=C(C=CC=C1OC)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H19NO4SSe/c1-12(18(21)22)24-25-16-14(9-6-10-15(16)23-2)17(20)19-11-13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3,(H,19,20)(H,21,22)