1-methyl-5,6-dihydro-4H-benzo[de]isoquinoline; 2,4,6-trinitrophenol

Systemtic Name: 1-methyl-5,6-dihydro-4H-benzo[de]isoquinoline; 2,4,6-trinitrophenol Openeye Name: 1-methyl-5,6-dihydro-4H-benzo[de]isoquinoline; picric acid CAS Name: 1-methyl-5,6-dihydro-4H-benzo[de]isoquinoline; 2,4,6-trinitrophenol IUPAC Name: 1-methyl-5,6-dihydro-4H-benzo[de]isoquinoline; 2,4,6-trinitrophenol Traditional Name: 1-methyl-5,6-dihydro-4H-benzo[de]isoquinoline; picric acid Formula: C19H16N4O7 MolecularWeight: 412.35294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2CCCC3=CC=CC1=C32.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C2CCCC3=CC=CC1=C32.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N.C6H3N3O7/c1-9-12-7-3-5-10-4-2-6-11(8-14-9)13(10)12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3,5,7-8H,2,4,6H2,1H3;1-2,10H