O4-(4-nitrophenyl) O1-octyl benzene-1,4-dicarboxylate

Systemtic Name: O4-(4-nitrophenyl) O1-octyl benzene-1,4-dicarboxylate Openeye Name: O4-(4-nitrophenyl) O1-octyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-(4-nitrophenyl) ester O1-octyl ester IUPAC Name: 4-O-(4-nitrophenyl) 1-O-octyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-(4-nitrophenyl) ester O1-octyl ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO6/c1-2-3-4-5-6-7-16-28-21(24)17-8-10-18(11-9-17)22(25)29-20-14-12-19(13-15-20)23(26)27/h8-15H,2-7,16H2,1H3