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4-[3-(benzotriazol-1-yl)propyl]morpholine; 2,4,6-trinitrophenol

4-[3-(benzotriazol-1-yl)propyl]morpholine; 2,4,6-trinitrophenol

Systemtic Name:4-[3-(benzotriazol-1-yl)propyl]morpholine; 2,4,6-trinitrophenol
Openeye Name:4-[3-(benzotriazol-1-yl)propyl]morpholine; picric acid
CAS Name:4-[3-(1-benzotriazolyl)propyl]morpholine; 2,4,6-trinitrophenol
IUPAC Name:4-[3-(benzotriazol-1-yl)propyl]morpholine; 2,4,6-trinitrophenol
Traditional Name:4-[3-(benzotriazol-1-yl)propyl]morpholine; picric acid
Formula: C19H21N7O8
MolecularWeight: 475.41214
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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN2C3=CC=CC=C3N=N2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

C1COCCN1CCCN2C3=CC=CC=C3N=N2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C13H18N4O.C6H3N3O7/c1-2-5-13-12(4-1)14-15-17(13)7-3-6-16-8-10-18-11-9-16;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2,4-5H,3,6-11H2;1-2,10H


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