3,5-bis(decanoylamino)benzoic acid

Systemtic Name: 3,5-bis(decanoylamino)benzoic acid Openeye Name: 3,5-bis(decanoylamino)benzoic acid CAS Name: 3,5-bis(1-oxodecylamino)benzoic acid IUPAC Name: 3,5-bis(decanoylamino)benzoic acid Traditional Name: 3,5-bis(caprylamino)benzoic acid Formula: C27H44N2O4 MolecularWeight: 460.64926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC1=CC(=CC(=C1)C(=O)O)NC(=O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(=O)NC1=CC(=CC(=C1)C(=O)O)NC(=O)CCCCCCCCC

InChI

InChI=1S/C27H44N2O4/c1-3-5-7-9-11-13-15-17-25(30)28-23-19-22(27(32)33)20-24(21-23)29-26(31)18-16-14-12-10-8-6-4-2/h19-21H,3-18H2,1-2H3,(H,28,30)(H,29,31)(H,32,33)