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methyl 4-acetamido-2-hexadecoxy-5-nitro-benzoate

methyl 4-acetamido-2-hexadecoxy-5-nitro-benzoate

Systemtic Name:methyl 4-acetamido-2-hexadecoxy-5-nitro-benzoate
Openeye Name:methyl 4-acetamido-2-hexadecoxy-5-nitro-benzoate
CAS Name:4-acetamido-2-hexadecoxy-5-nitrobenzoic acid methyl ester
IUPAC Name:methyl 4-acetamido-2-hexadecoxy-5-nitrobenzoate
Traditional Name:4-acetamido-2-cetyloxy-5-nitro-benzoic acid methyl ester
Formula: C26H42N2O6
MolecularWeight: 478.62148
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1C(=O)OC)[N+](=O)[O-])NC(=O)C


Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1C(=O)OC)[N+](=O)[O-])NC(=O)C


InChI

InChI=1S/C26H42N2O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-34-25-20-23(27-21(2)29)24(28(31)32)19-22(25)26(30)33-3/h19-20H,4-18H2,1-3H3,(H,27,29)


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