2-butylquinoline; 2,4,6-trinitrophenol

Systemtic Name: 2-butylquinoline; 2,4,6-trinitrophenol Openeye Name: 2-butylquinoline; picric acid CAS Name: 2-butylquinoline; 2,4,6-trinitrophenol IUPAC Name: 2-butylquinoline; 2,4,6-trinitrophenol Traditional Name: 2-butylquinoline; picric acid Formula: C19H18N4O7 MolecularWeight: 414.36882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2C=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2C=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H15N.C6H3N3O7/c1-2-3-7-12-10-9-11-6-4-5-8-13(11)14-12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h4-6,8-10H,2-3,7H2,1H3;1-2,10H