2-[(3-methyl-5-nitro-imidazol-4-yl)amino]-1-(4-nitrophenyl)ethanol

Systemtic Name: 2-[(3-methyl-5-nitro-imidazol-4-yl)amino]-1-(4-nitrophenyl)ethanol Openeye Name: 2-[(3-methyl-5-nitro-imidazol-4-yl)amino]-1-(4-nitrophenyl)ethanol CAS Name: 2-[(3-methyl-5-nitro-4-imidazolyl)amino]-1-(4-nitrophenyl)ethanol IUPAC Name: 2-[(3-methyl-5-nitroimidazol-4-yl)amino]-1-(4-nitrophenyl)ethanol Traditional Name: 2-[(3-methyl-5-nitro-imidazol-4-yl)amino]-1-(4-nitrophenyl)ethanol Formula: C12H13N5O5 MolecularWeight: 307.26212

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NCC(C2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NCC(C2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O5/c1-15-7-14-12(17(21)22)11(15)13-6-10(18)8-2-4-9(5-3-8)16(19)20/h2-5,7,10,13,18H,6H2,1H3