butyl 2-[4-[bis(2-chloroethyl)amino]phenyl]ethanoate

Systemtic Name: butyl 2-[4-[bis(2-chloroethyl)amino]phenyl]ethanoate Openeye Name: butyl 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate CAS Name: 2-[4-[bis(2-chloroethyl)amino]phenyl]acetic acid butyl ester IUPAC Name: butyl 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate Traditional Name: 2-[4-[bis(2-chloroethyl)amino]phenyl]acetic acid butyl ester Formula: C16H23Cl2NO2 MolecularWeight: 332.26532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl

Isomeric SMILES

CCCCOC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl

InChI

InChI=1S/C16H23Cl2NO2/c1-2-3-12-21-16(20)13-14-4-6-15(7-5-14)19(10-8-17)11-9-18/h4-7H,2-3,8-13H2,1H3