2-[[(4-azidophenyl)disulfanyl]methyl]-3-ethoxy-3-oxidanylidene-propanoate

Systemtic Name: 2-[[(4-azidophenyl)disulfanyl]methyl]-3-ethoxy-3-oxidanylidene-propanoate Openeye Name: 2-[[(4-azidophenyl)disulfanyl]methyl]-3-ethoxy-3-oxo-propanoate CAS Name: 2-[[(4-azidophenyl)disulfanyl]methyl]-3-ethoxy-3-oxopropanoate IUPAC Name: 2-[[(4-azidophenyl)disulfanyl]methyl]-3-ethoxy-3-oxopropanoate Traditional Name: 2-[[(4-azidophenyl)disulfanyl]methyl]-3-ethoxy-3-keto-propionate Formula: C12H12N3O4S2- MolecularWeight: 326.37138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSSC1=CC=C(C=C1)N=[N+]=[N-])C(=O)[O-]

Isomeric SMILES

CCOC(=O)C(CSSC1=CC=C(C=C1)N=[N+]=[N-])C(=O)[O-]

InChI

InChI=1S/C12H13N3O4S2/c1-2-19-12(18)10(11(16)17)7-20-21-9-5-3-8(4-6-9)14-15-13/h3-6,10H,2,7H2,1H3,(H,16,17)/p-1