butyl 4-[3-(propylamino)propanoylamino]benzoate chloride

Systemtic Name: butyl 4-[3-(propylamino)propanoylamino]benzoate chloride Openeye Name: butyl 4-[3-(propylamino)propanoylamino]benzoate chloride CAS Name: 4-[[1-oxo-3-(propylamino)propyl]amino]benzoic acid butyl ester chloride IUPAC Name: butyl 4-[3-(propylamino)propanoylamino]benzoate chloride Traditional Name: 4-[3-(propylamino)propanoylamino]benzoic acid butyl ester chloride Formula: C17H26ClN2O3- MolecularWeight: 341.85294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCNCCC.[Cl-]

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCNCCC.[Cl-]

InChI

InChI=1S/C17H26N2O3.ClH/c1-3-5-13-22-17(21)14-6-8-15(9-7-14)19-16(20)10-12-18-11-4-2;/h6-9,18H,3-5,10-13H2,1-2H3,(H,19,20);1H/p-1