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

Systemtic Name: 3-[[7-[furan-2-ylmethyl(oxolan-2-ylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Openeye Name: 3-[[7-[2-furylmethyl(tetrahydrofuran-2-ylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol CAS Name: 3-[[7-[2-furanylmethyl(2-oxolanylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-1-propanol IUPAC Name: 3-[[7-[furan-2-ylmethyl(oxolan-2-ylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Traditional Name: 3-[[7-[2-furfuryl(tetrahydrofurfuryl)amino]-4-nitro-benzofurazan-5-yl]amino]propan-1-ol Formula: C19H23N5O6 MolecularWeight: 417.41582

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=CC=CO2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCCO

Isomeric SMILES

C1CC(OC1)CN(CC2=CC=CO2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C19H23N5O6/c25-7-3-6-20-15-10-16(17-18(22-30-21-17)19(15)24(26)27)23(11-13-4-1-8-28-13)12-14-5-2-9-29-14/h1,4,8,10,14,20,25H,2-3,5-7,9,11-12H2