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

Systemtic Name: N-[4-[(4-nitro-7-pyrrolidin-1-yl-2,1,3-benzoxadiazol-5-yl)amino]phenyl]ethanamide Openeye Name: N-[4-[(4-nitro-7-pyrrolidin-1-yl-2,1,3-benzoxadiazol-5-yl)amino]phenyl]acetamide CAS Name: N-[4-[[4-nitro-7-(1-pyrrolidinyl)-2,1,3-benzoxadiazol-5-yl]amino]phenyl]acetamide IUPAC Name: N-[4-[(4-nitro-7-pyrrolidin-1-yl-2,1,3-benzoxadiazol-5-yl)amino]phenyl]acetamide Traditional Name: N-[4-[(4-nitro-7-pyrrolidino-benzofurazan-5-yl)amino]phenyl]acetamide Formula: C18H18N6O4 MolecularWeight: 382.37332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC2=C(C3=NON=C3C(=C2)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC2=C(C3=NON=C3C(=C2)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O4/c1-11(25)19-12-4-6-13(7-5-12)20-14-10-15(23-8-2-3-9-23)16-17(22-28-21-16)18(14)24(26)27/h4-7,10,20H,2-3,8-9H2,1H3,(H,19,25)