4-nitro-N7-[[(2R)-oxolan-2-yl]methyl]-N5-(phenylmethyl)-2,1,3-benzoxadiazole-5,7-diamine

Systemtic Name: 4-nitro-N7-[[(2R)-oxolan-2-yl]methyl]-N5-(phenylmethyl)-2,1,3-benzoxadiazole-5,7-diamine Openeye Name: N5-benzyl-4-nitro-N7-[[(2R)-tetrahydrofuran-2-yl]methyl]-2,1,3-benzoxadiazole-5,7-diamine CAS Name: 4-nitro-N7-[[(2R)-2-oxolanyl]methyl]-N5-(phenylmethyl)-2,1,3-benzoxadiazole-5,7-diamine IUPAC Name: 5-N-benzyl-4-nitro-7-N-[[(2R)-oxolan-2-yl]methyl]-2,1,3-benzoxadiazole-5,7-diamine Traditional Name: benzyl-[4-nitro-7-[[(2R)-tetrahydrofuran-2-yl]methylamino]benzofurazan-5-yl]amine Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](OC1)CNC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCC4=CC=CC=C4

InChI

InChI=1S/C18H19N5O4/c24-23(25)18-15(19-10-12-5-2-1-3-6-12)9-14(16-17(18)22-27-21-16)20-11-13-7-4-8-26-13/h1-3,5-6,9,13,19-20H,4,7-8,10-11H2/t13-/m1/s1