4-(dimethylamino)-2,2-diphenyl-pentanenitrile; 2,4,6-trinitrophenol

Systemtic Name: 4-(dimethylamino)-2,2-diphenyl-pentanenitrile; 2,4,6-trinitrophenol Openeye Name: 4-(dimethylamino)-2,2-diphenyl-pentanenitrile; picric acid CAS Name: 4-(dimethylamino)-2,2-diphenylpentanenitrile; 2,4,6-trinitrophenol IUPAC Name: 4-(dimethylamino)-2,2-diphenylpentanenitrile; 2,4,6-trinitrophenol Traditional Name: 4-(dimethylamino)-2,2-diphenyl-valeronitrile; picric acid Formula: C25H25N5O7 MolecularWeight: 507.4953

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)N(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)N(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H22N2.C6H3N3O7/c1-16(21(2)3)14-19(15-20,17-10-6-4-7-11-17)18-12-8-5-9-13-18;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h4-13,16H,14H2,1-3H3;1-2,10H