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methyl 2,4-didodecoxy-5-nitro-benzoate

methyl 2,4-didodecoxy-5-nitro-benzoate

Systemtic Name:methyl 2,4-didodecoxy-5-nitro-benzoate
Openeye Name:methyl 2,4-didodecoxy-5-nitro-benzoate
CAS Name:2,4-didodecoxy-5-nitrobenzoic acid methyl ester
IUPAC Name:methyl 2,4-didodecoxy-5-nitrobenzoate
Traditional Name:2,4-dilauryloxy-5-nitro-benzoic acid methyl ester
Formula: C32H55NO6
MolecularWeight: 549.7822
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=C(C=C1C(=O)OC)[N+](=O)[O-])OCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=C(C=C1C(=O)OC)[N+](=O)[O-])OCCCCCCCCCCCC


InChI

InChI=1S/C32H55NO6/c1-4-6-8-10-12-14-16-18-20-22-24-38-30-27-31(29(33(35)36)26-28(30)32(34)37-3)39-25-23-21-19-17-15-13-11-9-7-5-2/h26-27H,4-25H2,1-3H3


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