2-azanyl-4-[2-methoxy-6-(phenylcarbamoyl)phenyl]selanylsulfanyl-butanoic acid

Systemtic Name: 2-azanyl-4-[2-methoxy-6-(phenylcarbamoyl)phenyl]selanylsulfanyl-butanoic acid Openeye Name: 2-amino-4-[2-methoxy-6-(phenylcarbamoyl)phenyl]selanylsulfanyl-butanoic acid CAS Name: 2-amino-4-[[[2-[anilino(oxo)methyl]-6-methoxyphenyl]seleno]thio]butanoic acid IUPAC Name: 2-amino-4-[2-methoxy-6-(phenylcarbamoyl)phenyl]selanylsulfanylbutanoic acid Traditional Name: 2-amino-4-[[[2-methoxy-6-(phenylcarbamoyl)phenyl]seleno]thio]butyric acid Formula: C18H20N2O4SSe MolecularWeight: 439.3874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1[Se]SCCC(C(=O)O)N)C(=O)NC2=CC=CC=C2

Isomeric SMILES

COC1=CC=CC(=C1[Se]SCCC(C(=O)O)N)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O4SSe/c1-24-15-9-5-8-13(17(21)20-12-6-3-2-4-7-12)16(15)26-25-11-10-14(19)18(22)23/h2-9,14H,10-11,19H2,1H3,(H,20,21)(H,22,23)