2,4,6-trinitro-3-[(E)-2-(2,4,6-trinitrophenyl)ethenyl]phenol

Systemtic Name: 2,4,6-trinitro-3-[(E)-2-(2,4,6-trinitrophenyl)ethenyl]phenol Openeye Name: 2,4,6-trinitro-3-[(E)-2-(2,4,6-trinitrophenyl)vinyl]phenol CAS Name: 2,4,6-trinitro-3-[(E)-2-(2,4,6-trinitrophenyl)ethenyl]phenol IUPAC Name: 2,4,6-trinitro-3-[(E)-2-(2,4,6-trinitrophenyl)ethenyl]phenol Traditional Name: 2,4,6-trinitro-3-[(E)-2-picrylvinyl]phenol Formula: C14H6N6O13 MolecularWeight: 466.22984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H6N6O13/c21-14-12(19(30)31)5-11(18(28)29)8(13(14)20(32)33)2-1-7-9(16(24)25)3-6(15(22)23)4-10(7)17(26)27/h1-5,21H/b2-1+