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

Systemtic Name: O4-[4-(4-nitrophenyl)phenyl] O1-octyl benzene-1,4-dicarboxylate Openeye Name: O4-[4-(4-nitrophenyl)phenyl] O1-octyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[4-(4-nitrophenyl)phenyl] ester O1-octyl ester IUPAC Name: 4-O-[4-(4-nitrophenyl)phenyl] 1-O-octyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[4-(4-nitrophenyl)phenyl] ester O1-octyl ester Formula: C28H29NO6 MolecularWeight: 475.53296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C28H29NO6/c1-2-3-4-5-6-7-20-34-27(30)23-8-10-24(11-9-23)28(31)35-26-18-14-22(15-19-26)21-12-16-25(17-13-21)29(32)33/h8-19H,2-7,20H2,1H3