8-[(2-aminocarbonylphenyl)amino]octanoic acid

Systemtic Name: 8-[(2-aminocarbonylphenyl)amino]octanoic acid Openeye Name: 8-(2-carbamoylanilino)octanoic acid CAS Name: 8-(2-carbamoylanilino)octanoic acid IUPAC Name: 8-(2-carbamoylanilino)octanoic acid Traditional Name: 8-(2-carbamoylanilino)caprylic acid Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3/c16-15(20)12-8-5-6-9-13(12)17-11-7-3-1-2-4-10-14(18)19/h5-6,8-9,17H,1-4,7,10-11H2,(H2,16,20)(H,18,19)