N-(5-azanylpentyl)benzamide; 2,4,6-trinitrophenol

Systemtic Name: N-(5-azanylpentyl)benzamide; 2,4,6-trinitrophenol Openeye Name: N-(5-aminopentyl)benzamide; picric acid CAS Name: N-(5-aminopentyl)benzamide; 2,4,6-trinitrophenol IUPAC Name: N-(5-aminopentyl)benzamide; 2,4,6-trinitrophenol Traditional Name: N-(5-aminopentyl)benzamide; picric acid Formula: C18H21N5O8 MolecularWeight: 435.38804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCCCCN.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCCCCN.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O.C6H3N3O7/c13-9-5-2-6-10-14-12(15)11-7-3-1-4-8-11;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1,3-4,7-8H,2,5-6,9-10,13H2,(H,14,15);1-2,10H