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

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

Systemtic Name:octadecyl 2-[4-[bis(2-chloroethyl)amino]phenyl]ethanoate
Openeye Name:octadecyl 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
CAS Name:2-[4-[bis(2-chloroethyl)amino]phenyl]acetic acid octadecyl ester
IUPAC Name:octadecyl 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
Traditional Name:2-[4-[bis(2-chloroethyl)amino]phenyl]acetic acid stearyl ester
Formula: C30H51Cl2NO2
MolecularWeight: 528.63744
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C30H51Cl2NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-35-30(34)27-28-18-20-29(21-19-28)33(24-22-31)25-23-32/h18-21H,2-17,22-27H2,1H3


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