(4-nitrophenyl) 4-octoxybenzoate

Systemtic Name: (4-nitrophenyl) 4-octoxybenzoate Openeye Name: (4-nitrophenyl) 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid (4-nitrophenyl) ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H25NO5/c1-2-3-4-5-6-7-16-26-19-12-8-17(9-13-19)21(23)27-20-14-10-18(11-15-20)22(24)25/h8-15H,2-7,16H2,1H3