9-[1,7-bis(dibutylamino)heptan-4-yloxy]phenanthrene-2,7-dicarboxylic acid

Systemtic Name: 9-[1,7-bis(dibutylamino)heptan-4-yloxy]phenanthrene-2,7-dicarboxylic acid Openeye Name: 9-[4-(dibutylamino)-1-[3-(dibutylamino)propyl]butoxy]phenanthrene-2,7-dicarboxylic acid CAS Name: 9-[1,7-bis(dibutylamino)heptan-4-yloxy]phenanthrene-2,7-dicarboxylic acid IUPAC Name: 9-[1,7-bis(dibutylamino)heptan-4-yloxy]phenanthrene-2,7-dicarboxylic acid Traditional Name: 9-[4-(dibutylamino)-1-[3-(dibutylamino)propyl]butoxy]phenanthrene-2,7-dicarboxylic acid Formula: C39H58N2O5 MolecularWeight: 634.88822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCC(CCCN(CCCC)CCCC)OC1=C2C=C(C=CC2=C3C=CC(=CC3=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCN(CCCC)CCCC(CCCN(CCCC)CCCC)OC1=C2C=C(C=CC2=C3C=CC(=CC3=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C39H58N2O5/c1-5-9-21-40(22-10-6-2)25-13-15-33(16-14-26-41(23-11-7-3)24-12-8-4)46-37-29-32-27-30(38(42)43)17-19-34(32)35-20-18-31(39(44)45)28-36(35)37/h17-20,27-29,33H,5-16,21-26H2,1-4H3,(H,42,43)(H,44,45)