1,5-bis[(E)-2-(2,3-dinitrophenyl)ethenyl]-2,4-dinitro-benzene

Systemtic Name: 1,5-bis[(E)-2-(2,3-dinitrophenyl)ethenyl]-2,4-dinitro-benzene Openeye Name: 1,5-bis[(E)-2-(2,3-dinitrophenyl)vinyl]-2,4-dinitro-benzene CAS Name: 1,5-bis[(E)-2-(2,3-dinitrophenyl)ethenyl]-2,4-dinitrobenzene IUPAC Name: 1,5-bis[(E)-2-(2,3-dinitrophenyl)ethenyl]-2,4-dinitrobenzene Traditional Name: 1,5-bis[(E)-2-(2,3-dinitrophenyl)vinyl]-2,4-dinitro-benzene Formula: C22H12N6O12 MolecularWeight: 552.36368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])C=CC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C=CC3=C(C(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])/C=C/C2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])/C=C/C3=C(C(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H12N6O12/c29-23(30)17-5-1-3-13(21(17)27(37)38)7-9-15-11-16(20(26(35)36)12-19(15)25(33)34)10-8-14-4-2-6-18(24(31)32)22(14)28(39)40/h1-12H/b9-7+,10-8+