(2-nitrophenyl)methyl tetracosanoate

Systemtic Name: (2-nitrophenyl)methyl tetracosanoate Openeye Name: (2-nitrophenyl)methyl tetracosanoate CAS Name: tetracosanoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl tetracosanoate Traditional Name: lignoceric acid (2-nitrobenzyl) ester Formula: C31H53NO4 MolecularWeight: 503.75682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C31H53NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-31(33)36-28-29-25-23-24-26-30(29)32(34)35/h23-26H,2-22,27-28H2,1H3