5-(14-methylpentadecylamino)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(14-methylpentadecylamino)benzene-1,3-dicarboxylic acid Openeye Name: 5-(14-methylpentadecylamino)benzene-1,3-dicarboxylic acid CAS Name: 5-(14-methylpentadecylamino)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(14-methylpentadecylamino)benzene-1,3-dicarboxylic acid Traditional Name: 5-(14-methylpentadecylamino)isophthalic acid Formula: C24H39NO4 MolecularWeight: 405.57076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCNC1=CC(=CC(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)CCCCCCCCCCCCCNC1=CC(=CC(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C24H39NO4/c1-19(2)14-12-10-8-6-4-3-5-7-9-11-13-15-25-22-17-20(23(26)27)16-21(18-22)24(28)29/h16-19,25H,3-15H2,1-2H3,(H,26,27)(H,28,29)