2,3,3-trimethylindole; 2,4,6-trinitrophenol

Systemtic Name: 2,3,3-trimethylindole; 2,4,6-trinitrophenol Openeye Name: picric acid; 2,3,3-trimethylindole CAS Name: 2,3,3-trimethylindole; 2,4,6-trinitrophenol IUPAC Name: 2,3,3-trimethylindole; 2,4,6-trinitrophenol Traditional Name: picric acid; 2,3,3-trimethylindole Formula: C17H16N4O7 MolecularWeight: 388.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C1(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C1(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H13N.C6H3N3O7/c1-8-11(2,3)9-6-4-5-7-10(9)12-8;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h4-7H,1-3H3;1-2,10H