N-(3-methoxypropyl)-4-nitro-N-(pyridin-2-ylmethyl)-2,1,3-benzoxadiazol-5-amine

Systemtic Name: N-(3-methoxypropyl)-4-nitro-N-(pyridin-2-ylmethyl)-2,1,3-benzoxadiazol-5-amine Openeye Name: N-(3-methoxypropyl)-4-nitro-N-(2-pyridylmethyl)-2,1,3-benzoxadiazol-5-amine CAS Name: N-(3-methoxypropyl)-4-nitro-N-(2-pyridinylmethyl)-2,1,3-benzoxadiazol-5-amine IUPAC Name: N-(3-methoxypropyl)-4-nitro-N-(pyridin-2-ylmethyl)-2,1,3-benzoxadiazol-5-amine Traditional Name: 3-methoxypropyl-(4-nitrobenzofurazan-5-yl)-(2-pyridylmethyl)amine Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=CC=CC=N1)C2=C(C3=NON=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

COCCCN(CC1=CC=CC=N1)C2=C(C3=NON=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O4/c1-24-10-4-9-20(11-12-5-2-3-8-17-12)14-7-6-13-15(19-25-18-13)16(14)21(22)23/h2-3,5-8H,4,9-11H2,1H3