8-[[4-(hydroxymethyl)-2-methoxy-phenyl]carbonylamino]octanoic acid

Systemtic Name: 8-[[4-(hydroxymethyl)-2-methoxy-phenyl]carbonylamino]octanoic acid Openeye Name: 8-[[4-(hydroxymethyl)-2-methoxy-benzoyl]amino]octanoic acid CAS Name: 8-[[[4-(hydroxymethyl)-2-methoxyphenyl]-oxomethyl]amino]octanoic acid IUPAC Name: 8-[[4-(hydroxymethyl)-2-methoxybenzoyl]amino]octanoic acid Traditional Name: 8-[(2-methoxy-4-methylol-benzoyl)amino]caprylic acid Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CO)C(=O)NCCCCCCCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CO)C(=O)NCCCCCCCC(=O)O

InChI

InChI=1S/C17H25NO5/c1-23-15-11-13(12-19)8-9-14(15)17(22)18-10-6-4-2-3-5-7-16(20)21/h8-9,11,19H,2-7,10,12H2,1H3,(H,18,22)(H,20,21)