hexyl 4-[2-(3-methylphenoxy)ethanoylamino]benzoate

Systemtic Name: hexyl 4-[2-(3-methylphenoxy)ethanoylamino]benzoate Openeye Name: hexyl 4-[[2-(3-methylphenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(3-methylphenoxy)-1-oxoethyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[2-(3-methylphenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid hexyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=CC(=C2)C

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=CC(=C2)C

InChI

InChI=1S/C22H27NO4/c1-3-4-5-6-14-26-22(25)18-10-12-19(13-11-18)23-21(24)16-27-20-9-7-8-17(2)15-20/h7-13,15H,3-6,14,16H2,1-2H3,(H,23,24)