3-[2-(3-phenoxypropylamino)ethoxy]benzoic acid

Systemtic Name: 3-[2-(3-phenoxypropylamino)ethoxy]benzoic acid Openeye Name: 3-[2-(3-phenoxypropylamino)ethoxy]benzoic acid CAS Name: 3-[2-(3-phenoxypropylamino)ethoxy]benzoic acid IUPAC Name: 3-[2-(3-phenoxypropylamino)ethoxy]benzoic acid Traditional Name: 3-[2-(3-phenoxypropylamino)ethoxy]benzoic acid Formula: C18H21NO4 MolecularWeight: 315.36364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCNCCOC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OCCCNCCOC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C18H21NO4/c20-18(21)15-6-4-9-17(14-15)23-13-11-19-10-5-12-22-16-7-2-1-3-8-16/h1-4,6-9,14,19H,5,10-13H2,(H,20,21)