2-[(3-chlorophenyl)methoxy]-1,3,5-trinitro-benzene

Systemtic Name: 2-[(3-chlorophenyl)methoxy]-1,3,5-trinitro-benzene Openeye Name: 2-[(3-chlorophenyl)methoxy]-1,3,5-trinitro-benzene CAS Name: 2-[(3-chlorophenyl)methoxy]-1,3,5-trinitrobenzene IUPAC Name: 2-[(3-chlorophenyl)methoxy]-1,3,5-trinitrobenzene Traditional Name: 2-(3-chlorobenzyl)oxy-1,3,5-trinitro-benzene Formula: C13H8ClN3O7 MolecularWeight: 353.67152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)COC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)COC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H8ClN3O7/c14-9-3-1-2-8(4-9)7-24-13-11(16(20)21)5-10(15(18)19)6-12(13)17(22)23/h1-6H,7H2