5-(pentadecylamino)benzene-1,2,3-tricarboxylic acid

Systemtic Name: 5-(pentadecylamino)benzene-1,2,3-tricarboxylic acid Openeye Name: 5-(pentadecylamino)benzene-1,2,3-tricarboxylic acid CAS Name: 5-(pentadecylamino)benzene-1,2,3-tricarboxylic acid IUPAC Name: 5-(pentadecylamino)benzene-1,2,3-tricarboxylic acid Traditional Name: 5-(pentadecylamino)hemimellitic acid Formula: C24H37NO6 MolecularWeight: 435.55368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCNC1=CC(=C(C(=C1)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCNC1=CC(=C(C(=C1)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C24H37NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-25-18-16-19(22(26)27)21(24(30)31)20(17-18)23(28)29/h16-17,25H,2-15H2,1H3,(H,26,27)(H,28,29)(H,30,31)