3,3-bis(azanyl)-1-chloranyl-8-(4-nitro-2,1,3-benzoxadiazol-7-yl)octan-2-one

Systemtic Name: 3,3-bis(azanyl)-1-chloranyl-8-(4-nitro-2,1,3-benzoxadiazol-7-yl)octan-2-one Openeye Name: 3,3-diamino-1-chloro-8-(4-nitro-2,1,3-benzoxadiazol-7-yl)octan-2-one CAS Name: 3,3-diamino-1-chloro-8-(4-nitro-2,1,3-benzoxadiazol-7-yl)-2-octanone IUPAC Name: 3,3-diamino-1-chloro-8-(4-nitro-2,1,3-benzoxadiazol-7-yl)octan-2-one Traditional Name: 3,3-diamino-1-chloro-8-(7-nitrobenzofurazan-4-yl)octan-2-one Formula: C14H18ClN5O4 MolecularWeight: 355.77682

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=NON=C2C(=C1)[N+](=O)[O-])CCCCCC(C(=O)CCl)(N)N

Isomeric SMILES

C1=C(C2=NON=C2C(=C1)[N+](=O)[O-])CCCCCC(C(=O)CCl)(N)N

InChI

InChI=1S/C14H18ClN5O4/c15-8-11(21)14(16,17)7-3-1-2-4-9-5-6-10(20(22)23)13-12(9)18-24-19-13/h5-6H,1-4,7-8,16-17H2