6-methyl-1-propyl-pyrrolo[1,2-a]pyrazine; 2,4,6-trinitrophenol

Systemtic Name: 6-methyl-1-propyl-pyrrolo[1,2-a]pyrazine; 2,4,6-trinitrophenol Openeye Name: 6-methyl-1-propyl-pyrrolo[1,2-a]pyrazine; picric acid CAS Name: 6-methyl-1-propylpyrrolo[1,2-a]pyrazine; 2,4,6-trinitrophenol IUPAC Name: 6-methyl-1-propylpyrrolo[1,2-a]pyrazine; 2,4,6-trinitrophenol Traditional Name: 6-methyl-1-propyl-pyrrolo[1,2-a]pyrazine; picric acid Formula: C17H17N5O7 MolecularWeight: 403.34618

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=CN2C1=CC=C2C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCC1=NC=CN2C1=CC=C2C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H14N2.C6H3N3O7/c1-3-4-10-11-6-5-9(2)13(11)8-7-12-10;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h5-8H,3-4H2,1-2H3;1-2,10H