3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-one; 2,4,6-trinitrophenol

Systemtic Name: 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-one; 2,4,6-trinitrophenol Openeye Name: 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-one; picric acid CAS Name: 3-(dimethylamino)-1-(2-methoxyphenyl)-1-propanone; 2,4,6-trinitrophenol IUPAC Name: 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-one; 2,4,6-trinitrophenol Traditional Name: 3-(dimethylamino)-1-(2-methoxyphenyl)propan-1-one; picric acid Formula: C18H20N4O9 MolecularWeight: 436.3728

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC(=O)C1=CC=CC=C1OC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(C)CCC(=O)C1=CC=CC=C1OC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H17NO2.C6H3N3O7/c1-13(2)9-8-11(14)10-6-4-5-7-12(10)15-3;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h4-7H,8-9H2,1-3H3;1-2,10H