3-(hexadecanoylamino)-2-methyl-benzoic acid

Systemtic Name: 3-(hexadecanoylamino)-2-methyl-benzoic acid Openeye Name: 3-(hexadecanoylamino)-2-methyl-benzoic acid CAS Name: 2-methyl-3-(1-oxohexadecylamino)benzoic acid IUPAC Name: 3-(hexadecanoylamino)-2-methylbenzoic acid Traditional Name: 2-methyl-3-palmitamido-benzoic acid Formula: C24H39NO3 MolecularWeight: 389.57136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=CC=CC(=C1C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC=CC(=C1C)C(=O)O

InChI

InChI=1S/C24H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-23(26)25-22-18-16-17-21(20(22)2)24(27)28/h16-18H,3-15,19H2,1-2H3,(H,25,26)(H,27,28)