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

Systemtic Name: 3-[[7-[3-methoxypropyl(pyridin-2-ylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Openeye Name: 3-[[7-[3-methoxypropyl(2-pyridylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol CAS Name: 3-[[7-[3-methoxypropyl(2-pyridinylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-1-propanol IUPAC Name: 3-[[7-[3-methoxypropyl(pyridin-2-ylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Traditional Name: 3-[[7-[3-methoxypropyl(2-pyridylmethyl)amino]-4-nitro-benzofurazan-5-yl]amino]propan-1-ol Formula: C19H24N6O5 MolecularWeight: 416.43106

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=CC=CC=N1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCCO

Isomeric SMILES

COCCCN(CC1=CC=CC=N1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C19H24N6O5/c1-29-11-5-9-24(13-14-6-2-3-7-20-14)16-12-15(21-8-4-10-26)19(25(27)28)18-17(16)22-30-23-18/h2-3,6-7,12,21,26H,4-5,8-11,13H2,1H3