N-[4-[(4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazol-5-yl)amino]phenyl]ethanamide

Systemtic Name: N-[4-[(4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazol-5-yl)amino]phenyl]ethanamide Openeye Name: N-[4-[[4-nitro-7-(1-piperidyl)-2,1,3-benzoxadiazol-5-yl]amino]phenyl]acetamide CAS Name: N-[4-[[4-nitro-7-(1-piperidinyl)-2,1,3-benzoxadiazol-5-yl]amino]phenyl]acetamide IUPAC Name: N-[4-[(4-nitro-7-piperidin-1-yl-2,1,3-benzoxadiazol-5-yl)amino]phenyl]acetamide Traditional Name: N-[4-[(4-nitro-7-piperidino-benzofurazan-5-yl)amino]phenyl]acetamide Formula: C19H20N6O4 MolecularWeight: 396.3999

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC2=C(C3=NON=C3C(=C2)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC2=C(C3=NON=C3C(=C2)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O4/c1-12(26)20-13-5-7-14(8-6-13)21-15-11-16(24-9-3-2-4-10-24)17-18(23-29-22-17)19(15)25(27)28/h5-8,11,21H,2-4,9-10H2,1H3,(H,20,26)