4-(1-ethoxy-4-methyl-pentan-3-yl)morpholine; 2,4,6-trinitrophenol

Systemtic Name: 4-(1-ethoxy-4-methyl-pentan-3-yl)morpholine; 2,4,6-trinitrophenol Openeye Name: 4-[1-(2-ethoxyethyl)-2-methyl-propyl]morpholine; picric acid CAS Name: 4-(1-ethoxy-4-methylpentan-3-yl)morpholine; 2,4,6-trinitrophenol IUPAC Name: 4-(1-ethoxy-4-methylpentan-3-yl)morpholine; 2,4,6-trinitrophenol Traditional Name: 4-[1-(2-ethoxyethyl)-2-methyl-propyl]morpholine; picric acid Formula: C18H28N4O9 MolecularWeight: 444.43632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCC(C(C)C)N1CCOCC1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOCCC(C(C)C)N1CCOCC1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H25NO2.C6H3N3O7/c1-4-14-8-5-12(11(2)3)13-6-9-15-10-7-13;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h11-12H,4-10H2,1-3H3;1-2,10H