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

Systemtic Name: 3-[[7-(1-adamantylamino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Openeye Name: 3-[[7-(1-adamantylamino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol CAS Name: 3-[[7-(1-adamantylamino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-1-propanol IUPAC Name: 3-[[7-(1-adamantylamino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Traditional Name: 3-[[7-(1-adamantylamino)-4-nitro-benzofurazan-5-yl]amino]propan-1-ol Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC4=CC(=C(C5=NON=C45)[N+](=O)[O-])NCCCO

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC4=CC(=C(C5=NON=C45)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C19H25N5O4/c25-3-1-2-20-15-7-14(16-17(23-28-22-16)18(15)24(26)27)21-19-8-11-4-12(9-19)6-13(5-11)10-19/h7,11-13,20-21,25H,1-6,8-10H2