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4,7-bis(2-methylpropoxy)-1,10-phenanthroline-2,9-dicarboxylic acid

4,7-bis(2-methylpropoxy)-1,10-phenanthroline-2,9-dicarboxylic acid

Systemtic Name:4,7-bis(2-methylpropoxy)-1,10-phenanthroline-2,9-dicarboxylic acid
Openeye Name:4,7-diisobutoxy-1,10-phenanthroline-2,9-dicarboxylic acid
CAS Name:4,7-bis(2-methylpropoxy)-1,10-phenanthroline-2,9-dicarboxylic acid
IUPAC Name:4,7-bis(2-methylpropoxy)-1,10-phenanthroline-2,9-dicarboxylic acid
Traditional Name:4,7-diisobutoxy-1,10-phenanthroline-2,9-dicarboxylic acid
Formula: C22H24N2O6
MolecularWeight: 412.43576
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC(=NC2=C1C=CC3=C2N=C(C=C3OCC(C)C)C(=O)O)C(=O)O


Isomeric SMILES

CC(C)COC1=CC(=NC2=C1C=CC3=C2N=C(C=C3OCC(C)C)C(=O)O)C(=O)O


InChI

InChI=1S/C22H24N2O6/c1-11(2)9-29-17-7-15(21(25)26)23-19-13(17)5-6-14-18(30-10-12(3)4)8-16(22(27)28)24-20(14)19/h5-8,11-12H,9-10H2,1-4H3,(H,25,26)(H,27,28)


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