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[16-(4-nitrophenoxy)-16-oxidanylidene-hexadecyl] benzoate

[16-(4-nitrophenoxy)-16-oxidanylidene-hexadecyl] benzoate

Systemtic Name:[16-(4-nitrophenoxy)-16-oxidanylidene-hexadecyl] benzoate
Openeye Name:[16-(4-nitrophenoxy)-16-oxo-hexadecyl] benzoate
CAS Name:benzoic acid [16-(4-nitrophenoxy)-16-oxohexadecyl] ester
IUPAC Name:[16-(4-nitrophenoxy)-16-oxohexadecyl] benzoate
Traditional Name:benzoic acid [16-keto-16-(4-nitrophenoxy)hexadecyl] ester
Formula: C29H39NO6
MolecularWeight: 497.62306
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCCCCCCCCCCCCCCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCCCCCCCCCCCCCCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]


InChI

InChI=1S/C29H39NO6/c31-28(36-27-22-20-26(21-23-27)30(33)34)19-15-10-8-6-4-2-1-3-5-7-9-11-16-24-35-29(32)25-17-13-12-14-18-25/h12-14,17-18,20-23H,1-11,15-16,19,24H2


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