5-(dodecanoylamino)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(dodecanoylamino)benzene-1,3-dicarboxylic acid Openeye Name: 5-(dodecanoylamino)benzene-1,3-dicarboxylic acid CAS Name: 5-(1-oxododecylamino)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(dodecanoylamino)benzene-1,3-dicarboxylic acid Traditional Name: 5-(lauroylamino)isophthalic acid Formula: C20H29NO5 MolecularWeight: 363.44796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC(=CC(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC(=CC(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C20H29NO5/c1-2-3-4-5-6-7-8-9-10-11-18(22)21-17-13-15(19(23)24)12-16(14-17)20(25)26/h12-14H,2-11H2,1H3,(H,21,22)(H,23,24)(H,25,26)