4-[(4-methyl-2-nitro-phenoxy)methyl]-3-nitro-benzamide

Systemtic Name: 4-[(4-methyl-2-nitro-phenoxy)methyl]-3-nitro-benzamide Openeye Name: 4-[(4-methyl-2-nitro-phenoxy)methyl]-3-nitro-benzamide CAS Name: 4-[(4-methyl-2-nitrophenoxy)methyl]-3-nitrobenzamide IUPAC Name: 4-[(4-methyl-2-nitrophenoxy)methyl]-3-nitrobenzamide Traditional Name: 4-[(4-methyl-2-nitro-phenoxy)methyl]-3-nitro-benzamide Formula: C15H13N3O6 MolecularWeight: 331.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O6/c1-9-2-5-14(13(6-9)18(22)23)24-8-11-4-3-10(15(16)19)7-12(11)17(20)21/h2-7H,8H2,1H3,(H2,16,19)