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2-(dioxidanylmethyl)-4-nitro-1-octadecoxy-benzene

2-(dioxidanylmethyl)-4-nitro-1-octadecoxy-benzene

Systemtic Name:2-(dioxidanylmethyl)-4-nitro-1-octadecoxy-benzene
Openeye Name:2-(hydroperoxymethyl)-4-nitro-1-octadecoxy-benzene
CAS Name:2-(hydroperoxymethyl)-4-nitro-1-octadecoxybenzene
IUPAC Name:2-(hydroperoxymethyl)-4-nitro-1-octadecoxybenzene
Traditional Name:2-(hydroperoxymethyl)-4-nitro-1-stearyloxy-benzene
Formula: C25H43NO5
MolecularWeight: 437.61262
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])COO


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])COO


InChI

InChI=1S/C25H43NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-30-25-19-18-24(26(27)28)21-23(25)22-31-29/h18-19,21,29H,2-17,20,22H2,1H3


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