8-[(3,5-dimethoxy-4-oxidanyl-phenyl)carbonylamino]octanoic acid

Systemtic Name: 8-[(3,5-dimethoxy-4-oxidanyl-phenyl)carbonylamino]octanoic acid Openeye Name: 8-[(4-hydroxy-3,5-dimethoxy-benzoyl)amino]octanoic acid CAS Name: 8-[[(4-hydroxy-3,5-dimethoxyphenyl)-oxomethyl]amino]octanoic acid IUPAC Name: 8-[(4-hydroxy-3,5-dimethoxybenzoyl)amino]octanoic acid Traditional Name: 8-(syringoylamino)caprylic acid Formula: C17H25NO6 MolecularWeight: 339.3835

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C(=O)NCCCCCCCC(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C(=O)NCCCCCCCC(=O)O

InChI

InChI=1S/C17H25NO6/c1-23-13-10-12(11-14(24-2)16(13)21)17(22)18-9-7-5-3-4-6-8-15(19)20/h10-11,21H,3-9H2,1-2H3,(H,18,22)(H,19,20)