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

Systemtic Name: 3-[[7-[cyclopentyl(pyridin-4-ylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Openeye Name: 3-[[7-[cyclopentyl(4-pyridylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol CAS Name: 3-[[7-[cyclopentyl(pyridin-4-ylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-1-propanol IUPAC Name: 3-[[7-[cyclopentyl(pyridin-4-ylmethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Traditional Name: 3-[[7-[cyclopentyl(4-pyridylmethyl)amino]-4-nitro-benzofurazan-5-yl]amino]propan-1-ol Formula: C20H24N6O4 MolecularWeight: 412.44236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC=NC=C2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCCO

Isomeric SMILES

C1CCC(C1)N(CC2=CC=NC=C2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C20H24N6O4/c27-11-3-8-22-16-12-17(18-19(24-30-23-18)20(16)26(28)29)25(15-4-1-2-5-15)13-14-6-9-21-10-7-14/h6-7,9-10,12,15,22,27H,1-5,8,11,13H2