3-[(4-nitro-7-propylsulfanyl-2,1,3-benzoxadiazol-5-yl)amino]propan-1-ol

Systemtic Name: 3-[(4-nitro-7-propylsulfanyl-2,1,3-benzoxadiazol-5-yl)amino]propan-1-ol Openeye Name: 3-[(4-nitro-7-propylsulfanyl-2,1,3-benzoxadiazol-5-yl)amino]propan-1-ol CAS Name: 3-[[4-nitro-7-(propylthio)-2,1,3-benzoxadiazol-5-yl]amino]-1-propanol IUPAC Name: 3-[(4-nitro-7-propylsulfanyl-2,1,3-benzoxadiazol-5-yl)amino]propan-1-ol Traditional Name: 3-[[4-nitro-7-(propylthio)benzofurazan-5-yl]amino]propan-1-ol Formula: C12H16N4O4S MolecularWeight: 312.34484

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C2=NON=C12)[N+](=O)[O-])NCCCO

Isomeric SMILES

CCCSC1=CC(=C(C2=NON=C12)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C12H16N4O4S/c1-2-6-21-9-7-8(13-4-3-5-17)12(16(18)19)11-10(9)14-20-15-11/h7,13,17H,2-6H2,1H3