8-[2-(propan-2-ylcarbamoyl)phenoxy]octanoic acid

Systemtic Name: 8-[2-(propan-2-ylcarbamoyl)phenoxy]octanoic acid Openeye Name: 8-[2-(isopropylcarbamoyl)phenoxy]octanoic acid CAS Name: 8-[2-[oxo-(propan-2-ylamino)methyl]phenoxy]octanoic acid IUPAC Name: 8-[2-(propan-2-ylcarbamoyl)phenoxy]octanoic acid Traditional Name: 8-[2-(isopropylcarbamoyl)phenoxy]caprylic acid Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=CC=C1OCCCCCCCC(=O)O

Isomeric SMILES

CC(C)NC(=O)C1=CC=CC=C1OCCCCCCCC(=O)O

InChI

InChI=1S/C18H27NO4/c1-14(2)19-18(22)15-10-7-8-11-16(15)23-13-9-5-3-4-6-12-17(20)21/h7-8,10-11,14H,3-6,9,12-13H2,1-2H3,(H,19,22)(H,20,21)