aluminum 2-methyl-1,3,5-trinitro-benzene

Systemtic Name: aluminum 2-methyl-1,3,5-trinitro-benzene Openeye Name: aluminum 2-methyl-1,3,5-trinitro-benzene CAS Name: aluminum 2-methyl-1,3,5-trinitrobenzene IUPAC Name: aluminum 2-methyl-1,3,5-trinitrobenzene Traditional Name: aluminum 2-methyl-1,3,5-trinitro-benzene Formula: C7H5AlN3O6+3 MolecularWeight: 254.112638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].[Al+3]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].[Al+3]

InChI

InChI=1S/C7H5N3O6.Al/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16;/h2-3H,1H3;/q;+3