8-[[5-(aminomethyl)-2-oxidanyl-phenyl]carbonylamino]octanoic acid

Systemtic Name: 8-[[5-(aminomethyl)-2-oxidanyl-phenyl]carbonylamino]octanoic acid Openeye Name: 8-[[5-(aminomethyl)-2-hydroxy-benzoyl]amino]octanoic acid CAS Name: 8-[[[5-(aminomethyl)-2-hydroxyphenyl]-oxomethyl]amino]octanoic acid IUPAC Name: 8-[[5-(aminomethyl)-2-hydroxybenzoyl]amino]octanoic acid Traditional Name: 8-[[5-(aminomethyl)-2-hydroxy-benzoyl]amino]caprylic acid Formula: C16H24N2O4 MolecularWeight: 308.37276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN)C(=O)NCCCCCCCC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1CN)C(=O)NCCCCCCCC(=O)O)O

InChI

InChI=1S/C16H24N2O4/c17-11-12-7-8-14(19)13(10-12)16(22)18-9-5-3-1-2-4-6-15(20)21/h7-8,10,19H,1-6,9,11,17H2,(H,18,22)(H,20,21)