2-[[4-nitro-7-(quinolin-6-ylamino)-2,1,3-benzoxadiazol-5-yl]amino]ethanol

Systemtic Name: 2-[[4-nitro-7-(quinolin-6-ylamino)-2,1,3-benzoxadiazol-5-yl]amino]ethanol Openeye Name: 2-[[4-nitro-7-(6-quinolylamino)-2,1,3-benzoxadiazol-5-yl]amino]ethanol CAS Name: 2-[[4-nitro-7-(6-quinolinylamino)-2,1,3-benzoxadiazol-5-yl]amino]ethanol IUPAC Name: 2-[[4-nitro-7-(quinolin-6-ylamino)-2,1,3-benzoxadiazol-5-yl]amino]ethanol Traditional Name: 2-[[4-nitro-7-(6-quinolylamino)benzofurazan-5-yl]amino]ethanol Formula: C17H14N6O4 MolecularWeight: 366.33086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)NC3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCO)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)NC3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCO)N=C1

InChI

InChI=1S/C17H14N6O4/c24-7-6-19-14-9-13(15-16(22-27-21-15)17(14)23(25)26)20-11-3-4-12-10(8-11)2-1-5-18-12/h1-5,8-9,19-20,24H,6-7H2