4-(phenylmethyl)morpholine; 2,4,6-trinitrophenol

Systemtic Name: 4-(phenylmethyl)morpholine; 2,4,6-trinitrophenol Openeye Name: 4-benzylmorpholine; picric acid CAS Name: 4-(phenylmethyl)morpholine; 2,4,6-trinitrophenol IUPAC Name: 4-benzylmorpholine; 2,4,6-trinitrophenol Traditional Name: 4-benzylmorpholine; picric acid Formula: C17H18N4O8 MolecularWeight: 406.34682

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CC2=CC=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H15NO.C6H3N3O7/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-5H,6-10H2;1-2,10H