2-azanyl-3-octanoyloxy-benzoic acid

Systemtic Name: 2-azanyl-3-octanoyloxy-benzoic acid Openeye Name: 2-amino-3-octanoyloxy-benzoic acid CAS Name: 2-amino-3-(1-oxooctoxy)benzoic acid IUPAC Name: 2-amino-3-octanoyloxybenzoic acid Traditional Name: 2-amino-3-caprylyloxy-benzoic acid Formula: C15H21NO4 MolecularWeight: 279.33154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=CC(=C1N)C(=O)O

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=CC(=C1N)C(=O)O

InChI

InChI=1S/C15H21NO4/c1-2-3-4-5-6-10-13(17)20-12-9-7-8-11(14(12)16)15(18)19/h7-9H,2-6,10,16H2,1H3,(H,18,19)