(4-undecoxycarbonylphenyl) 4-nitrobenzoate

Systemtic Name: (4-undecoxycarbonylphenyl) 4-nitrobenzoate Openeye Name: (4-undecoxycarbonylphenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[oxo(undecoxy)methyl]phenyl] ester IUPAC Name: (4-undecoxycarbonylphenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (4-undecoxycarbonylphenyl) ester Formula: C25H31NO6 MolecularWeight: 441.51674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C25H31NO6/c1-2-3-4-5-6-7-8-9-10-19-31-24(27)20-13-17-23(18-14-20)32-25(28)21-11-15-22(16-12-21)26(29)30/h11-18H,2-10,19H2,1H3