2-aminocarbonyl-3-octadecyl-benzoic acid

Systemtic Name: 2-aminocarbonyl-3-octadecyl-benzoic acid Openeye Name: 2-carbamoyl-3-octadecyl-benzoic acid CAS Name: 2-carbamoyl-3-octadecylbenzoic acid IUPAC Name: 2-carbamoyl-3-octadecylbenzoic acid Traditional Name: 2-carbamoyl-3-stearyl-benzoic acid Formula: C26H43NO3 MolecularWeight: 417.62452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC=CC(=C1C(=O)N)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC=CC(=C1C(=O)N)C(=O)O

InChI

InChI=1S/C26H43NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-20-18-21-23(26(29)30)24(22)25(27)28/h18,20-21H,2-17,19H2,1H3,(H2,27,28)(H,29,30)