1-[5-(dimethylaminomethyl)furan-2-yl]-N,N-dimethyl-methanamine; 2,4,6-trinitrophenol

Systemtic Name: 1-[5-(dimethylaminomethyl)furan-2-yl]-N,N-dimethyl-methanamine; 2,4,6-trinitrophenol Openeye Name: 1-[5-(dimethylaminomethyl)-2-furyl]-N,N-dimethyl-methanamine; picric acid CAS Name: 1-[5-(dimethylaminomethyl)-2-furanyl]-N,N-dimethylmethanamine; 2,4,6-trinitrophenol IUPAC Name: 1-[5-(dimethylaminomethyl)furan-2-yl]-N,N-dimethylmethanamine; 2,4,6-trinitrophenol Traditional Name: [5-(dimethylaminomethyl)-2-furyl]methyl-dimethyl-amine; picric acid Formula: C16H21N5O8 MolecularWeight: 411.36664

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(O1)CN(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=C(O1)CN(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H18N2O.C6H3N3O7/c1-11(2)7-9-5-6-10(13-9)8-12(3)4;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h5-6H,7-8H2,1-4H3;1-2,10H