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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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