2-[(E)-2-(4-chlorophenyl)ethenyl]-1,3,5-trinitro-benzene

Systemtic Name: 2-[(E)-2-(4-chlorophenyl)ethenyl]-1,3,5-trinitro-benzene Openeye Name: 2-[(E)-2-(4-chlorophenyl)vinyl]-1,3,5-trinitro-benzene CAS Name: 2-[(E)-2-(4-chlorophenyl)ethenyl]-1,3,5-trinitrobenzene IUPAC Name: 2-[(E)-2-(4-chlorophenyl)ethenyl]-1,3,5-trinitrobenzene Traditional Name: 2-[(E)-2-(4-chlorophenyl)vinyl]-1,3,5-trinitro-benzene Formula: C14H8ClN3O6 MolecularWeight: 349.68282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C14H8ClN3O6/c15-10-4-1-9(2-5-10)3-6-12-13(17(21)22)7-11(16(19)20)8-14(12)18(23)24/h1-8H/b6-3+