(4-nitrophenyl) 3,4-didodecoxybenzoate

Systemtic Name: (4-nitrophenyl) 3,4-didodecoxybenzoate Openeye Name: (4-nitrophenyl) 3,4-didodecoxybenzoate CAS Name: 3,4-didodecoxybenzoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3,4-didodecoxybenzoate Traditional Name: 3,4-dilauryloxybenzoic acid (4-nitrophenyl) ester Formula: C37H57NO6 MolecularWeight: 611.85158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])OCCCCCCCCCCCC

InChI

InChI=1S/C37H57NO6/c1-3-5-7-9-11-13-15-17-19-21-29-42-35-28-23-32(37(39)44-34-26-24-33(25-27-34)38(40)41)31-36(35)43-30-22-20-18-16-14-12-10-8-6-4-2/h23-28,31H,3-22,29-30H2,1-2H3