2-[[7-(furan-2-ylmethylsulfanyl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethyl ethanoate

Systemtic Name: 2-[[7-(furan-2-ylmethylsulfanyl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethyl ethanoate Openeye Name: 2-[[7-(2-furylmethylsulfanyl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethyl acetate CAS Name: acetic acid 2-[[7-(2-furanylmethylthio)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethyl ester IUPAC Name: 2-[[7-(furan-2-ylmethylsulfanyl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethyl acetate Traditional Name: acetic acid 2-[[7-(2-furfurylthio)-4-nitro-benzofurazan-5-yl]amino]ethyl ester Formula: C15H14N4O6S MolecularWeight: 378.35986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCNC1=C(C2=NON=C2C(=C1)SCC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCNC1=C(C2=NON=C2C(=C1)SCC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O6S/c1-9(20)23-6-4-16-11-7-12(26-8-10-3-2-5-24-10)13-14(18-25-17-13)15(11)19(21)22/h2-3,5,7,16H,4,6,8H2,1H3