9-[1,5-bis(diethylamino)pentan-3-yloxy]phenanthrene-2,7-dicarboxylic acid

Systemtic Name: 9-[1,5-bis(diethylamino)pentan-3-yloxy]phenanthrene-2,7-dicarboxylic acid Openeye Name: 9-[3-(diethylamino)-1-(2-diethylaminoethyl)propoxy]phenanthrene-2,7-dicarboxylic acid CAS Name: 9-[1,5-bis(diethylamino)pentan-3-yloxy]phenanthrene-2,7-dicarboxylic acid IUPAC Name: 9-[1,5-bis(diethylamino)pentan-3-yloxy]phenanthrene-2,7-dicarboxylic acid Traditional Name: 9-[3-(diethylamino)-1-(2-diethylaminoethyl)propoxy]phenanthrene-2,7-dicarboxylic acid Formula: C29H38N2O5 MolecularWeight: 494.62242

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(CCN(CC)CC)OC1=C2C=C(C=CC2=C3C=CC(=CC3=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)CCC(CCN(CC)CC)OC1=C2C=C(C=CC2=C3C=CC(=CC3=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C29H38N2O5/c1-5-30(6-2)15-13-23(14-16-31(7-3)8-4)36-27-19-22-17-20(28(32)33)9-11-24(22)25-12-10-21(29(34)35)18-26(25)27/h9-12,17-19,23H,5-8,13-16H2,1-4H3,(H,32,33)(H,34,35)