2-[2-chloroethyl(ethyl)amino]ethyl benzoate

Systemtic Name: 2-[2-chloroethyl(ethyl)amino]ethyl benzoate Openeye Name: 2-[2-chloroethyl(ethyl)amino]ethyl benzoate CAS Name: benzoic acid 2-[2-chloroethyl(ethyl)amino]ethyl ester IUPAC Name: 2-[2-chloroethyl(ethyl)amino]ethyl benzoate Traditional Name: benzoic acid 2-[2-chloroethyl(ethyl)amino]ethyl ester Formula: C13H18ClNO2 MolecularWeight: 255.74052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCOC(=O)C1=CC=CC=C1)CCCl

Isomeric SMILES

CCN(CCOC(=O)C1=CC=CC=C1)CCCl

InChI

InChI=1S/C13H18ClNO2/c1-2-15(9-8-14)10-11-17-13(16)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3