ethyl 3-(1,3-benzoselenazol-2-ylsulfanyl)-2-oxidanylidene-propanoate

Systemtic Name: ethyl 3-(1,3-benzoselenazol-2-ylsulfanyl)-2-oxidanylidene-propanoate Openeye Name: ethyl 3-(1,3-benzoselenazol-2-ylsulfanyl)-2-oxo-propanoate CAS Name: 3-(1,3-benzoselenazol-2-ylthio)-2-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzoselenazol-2-ylsulfanyl)-2-oxopropanoate Traditional Name: 3-(1,3-benzoselenazol-2-ylthio)-2-keto-propionic acid ethyl ester Formula: C12H11NO3SSe MolecularWeight: 328.24564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CSC1=NC2=CC=CC=C2[Se]1

Isomeric SMILES

CCOC(=O)C(=O)CSC1=NC2=CC=CC=C2[Se]1

InChI

InChI=1S/C12H11NO3SSe/c1-2-16-11(15)9(14)7-17-12-13-8-5-3-4-6-10(8)18-12/h3-6H,2,7H2,1H3