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

Systemtic Name: 2-[methyl-[4-nitro-7-(prop-2-enylamino)-2,1,3-benzoxadiazol-5-yl]amino]ethanol Openeye Name: 2-[[7-(allylamino)-4-nitro-2,1,3-benzoxadiazol-5-yl]-methyl-amino]ethanol CAS Name: 2-[methyl-[4-nitro-7-(prop-2-enylamino)-2,1,3-benzoxadiazol-5-yl]amino]ethanol IUPAC Name: 2-[methyl-[4-nitro-7-(prop-2-enylamino)-2,1,3-benzoxadiazol-5-yl]amino]ethanol Traditional Name: 2-[[7-(allylamino)-4-nitro-benzofurazan-5-yl]-methyl-amino]ethanol Formula: C12H15N5O4 MolecularWeight: 293.2786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N5O4/c1-3-4-13-8-7-9(16(2)5-6-18)12(17(19)20)11-10(8)14-21-15-11/h3,7,13,18H,1,4-6H2,2H3