5-nitro-2-[(4-nitrophenyl)methyl]phenol

Systemtic Name: 5-nitro-2-[(4-nitrophenyl)methyl]phenol Openeye Name: 5-nitro-2-[(4-nitrophenyl)methyl]phenol CAS Name: 5-nitro-2-[(4-nitrophenyl)methyl]phenol IUPAC Name: 5-nitro-2-[(4-nitrophenyl)methyl]phenol Traditional Name: 5-nitro-2-(4-nitrobenzyl)phenol Formula: C13H10N2O5 MolecularWeight: 274.2289

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=C(C=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC2=C(C=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O5/c16-13-8-12(15(19)20)6-3-10(13)7-9-1-4-11(5-2-9)14(17)18/h1-6,8,16H,7H2