(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methanamine; 2,4,6-trinitrophenol

Systemtic Name: (2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methanamine; 2,4,6-trinitrophenol Openeye Name: (2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methanamine; picric acid CAS Name: (2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methanamine; 2,4,6-trinitrophenol IUPAC Name: (2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methanamine; 2,4,6-trinitrophenol Traditional Name: (2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methylamine; picric acid Formula: C17H19N5O7 MolecularWeight: 405.36206

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC=CC=C2C1CN.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1CCC2=CC=CC=C2C1CN.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H16N2.C6H3N3O7/c1-13-7-6-9-4-2-3-5-10(9)11(13)8-12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-5,11H,6-8,12H2,1H3;1-2,10H