2-[methyl-[4-nitro-7-[(phenylmethyl)amino]-2,1,3-benzoxadiazol-5-yl]amino]ethanol

Systemtic Name: 2-[methyl-[4-nitro-7-[(phenylmethyl)amino]-2,1,3-benzoxadiazol-5-yl]amino]ethanol Openeye Name: 2-[[7-(benzylamino)-4-nitro-2,1,3-benzoxadiazol-5-yl]-methyl-amino]ethanol CAS Name: 2-[methyl-[4-nitro-7-[(phenylmethyl)amino]-2,1,3-benzoxadiazol-5-yl]amino]ethanol IUPAC Name: 2-[[7-(benzylamino)-4-nitro-2,1,3-benzoxadiazol-5-yl]-methylamino]ethanol Traditional Name: 2-[[7-(benzylamino)-4-nitro-benzofurazan-5-yl]-methyl-amino]ethanol Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCO)C1=C(C2=NON=C2C(=C1)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CCO)C1=C(C2=NON=C2C(=C1)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

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