benzo[a]anthracene; 1,3,5-trinitrobenzene

Systemtic Name: benzo[a]anthracene; 1,3,5-trinitrobenzene Openeye Name: benzo[a]anthracene; 1,3,5-trinitrobenzene CAS Name: benzo[a]anthracene; 1,3,5-trinitrobenzene IUPAC Name: benzo[a]anthracene; 1,3,5-trinitrobenzene Traditional Name: benz[a]anthracene; 1,3,5-trinitrobenzene Formula: C24H15N3O6 MolecularWeight: 441.3924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=CC4=CC=CC=C4C=C32.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=CC4=CC=CC=C4C=C32.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H12.C6H3N3O6/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18;10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-12H;1-3H