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

Systemtic Name: N,N-dimethyl-1-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methanamine; 2,4,6-trinitrophenol Openeye Name: N,N-dimethyl-1-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methanamine; picric acid CAS Name: N,N-dimethyl-1-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methanamine; 2,4,6-trinitrophenol IUPAC Name: N,N-dimethyl-1-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methanamine; 2,4,6-trinitrophenol Traditional Name: dimethyl-[(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]amine; picric acid Formula: C19H23N5O7 MolecularWeight: 433.41522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2.C6H3N3O7/c1-14(2)10-13-12-7-5-4-6-11(12)8-9-15(13)3;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h4-7,13H,8-10H2,1-3H3;1-2,10H