bis[(4-methoxyphenyl)methyl] 5-[2-(dihexylamino)-2-oxidanylidene-ethoxy]-2-nitro-benzene-1,3-dicarboxylate

Systemtic Name: bis[(4-methoxyphenyl)methyl] 5-[2-(dihexylamino)-2-oxidanylidene-ethoxy]-2-nitro-benzene-1,3-dicarboxylate Openeye Name: bis[(4-methoxyphenyl)methyl] 5-[2-(dihexylamino)-2-oxo-ethoxy]-2-nitro-benzene-1,3-dicarboxylate CAS Name: 5-[2-(dihexylamino)-2-oxoethoxy]-2-nitrobenzene-1,3-dicarboxylic acid bis[(4-methoxyphenyl)methyl] ester IUPAC Name: bis[(4-methoxyphenyl)methyl] 5-[2-(dihexylamino)-2-oxoethoxy]-2-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-[2-(dihexylamino)-2-keto-ethoxy]-2-nitro-benzene-1,3-dicarboxylic acid bis(p-anisyl) ester Formula: C38H48N2O10 MolecularWeight: 692.79512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(=O)COC1=CC(=C(C(=C1)C(=O)OCC2=CC=C(C=C2)OC)[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCN(CCCCCC)C(=O)COC1=CC(=C(C(=C1)C(=O)OCC2=CC=C(C=C2)OC)[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)OC

InChI

InChI=1S/C38H48N2O10/c1-5-7-9-11-21-39(22-12-10-8-6-2)35(41)27-48-32-23-33(37(42)49-25-28-13-17-30(46-3)18-14-28)36(40(44)45)34(24-32)38(43)50-26-29-15-19-31(47-4)20-16-29/h13-20,23-24H,5-12,21-22,25-27H2,1-4H3