2-[5-[(2-methoxyphenyl)amino]-2,4-dinitro-imidazol-1-yl]ethanol

Systemtic Name: 2-[5-[(2-methoxyphenyl)amino]-2,4-dinitro-imidazol-1-yl]ethanol Openeye Name: 2-[5-(2-methoxyanilino)-2,4-dinitro-imidazol-1-yl]ethanol CAS Name: 2-[5-(2-methoxyanilino)-2,4-dinitro-1-imidazolyl]ethanol IUPAC Name: 2-[5-(2-methoxyanilino)-2,4-dinitroimidazol-1-yl]ethanol Traditional Name: 2-[2,4-dinitro-5-(o-anisidino)imidazol-1-yl]ethanol Formula: C12H13N5O6 MolecularWeight: 323.26152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=C(N=C(N2CCO)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC2=C(N=C(N2CCO)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O6/c1-23-9-5-3-2-4-8(9)13-10-11(16(19)20)14-12(17(21)22)15(10)6-7-18/h2-5,13,18H,6-7H2,1H3