3-(6-ethoxyquinolin-2-yl)aniline; 2,4,6-trinitrophenol

Systemtic Name: 3-(6-ethoxyquinolin-2-yl)aniline; 2,4,6-trinitrophenol Openeye Name: 3-(6-ethoxy-2-quinolyl)aniline; picric acid CAS Name: 3-(6-ethoxy-2-quinolinyl)aniline; 2,4,6-trinitrophenol IUPAC Name: 3-(6-ethoxyquinolin-2-yl)aniline; 2,4,6-trinitrophenol Traditional Name: [3-(6-ethoxy-2-quinolyl)phenyl]amine; picric acid Formula: C23H19N5O8 MolecularWeight: 493.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(C=C2)C3=CC(=CC=C3)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(C=C2)C3=CC(=CC=C3)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O.C6H3N3O7/c1-2-20-15-7-9-17-13(11-15)6-8-16(19-17)12-4-3-5-14(18)10-12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-11H,2,18H2,1H3;1-2,10H