2-(4-ethoxy-3-methoxy-phenyl)ethanamine; 2,4,6-trinitrophenol

Systemtic Name: 2-(4-ethoxy-3-methoxy-phenyl)ethanamine; 2,4,6-trinitrophenol Openeye Name: 2-(4-ethoxy-3-methoxy-phenyl)ethanamine; picric acid CAS Name: 2-(4-ethoxy-3-methoxyphenyl)ethanamine; 2,4,6-trinitrophenol IUPAC Name: 2-(4-ethoxy-3-methoxyphenyl)ethanamine; 2,4,6-trinitrophenol Traditional Name: 2-(4-ethoxy-3-methoxy-phenyl)ethylamine; picric acid Formula: C17H20N4O9 MolecularWeight: 424.3621

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCN)OC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCN)OC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H17NO2.C6H3N3O7/c1-3-14-10-5-4-9(6-7-12)8-11(10)13-2;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h4-5,8H,3,6-7,12H2,1-2H3;1-2,10H