methyl 3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate

Systemtic Name: methyl 3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate Openeye Name: methyl 3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate CAS Name: 3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate Traditional Name: 3-[4-[bis(2-chloroethyl)amino]phenyl]propionic acid methyl ester Formula: C14H19Cl2NO2 MolecularWeight: 304.21216

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)N(CCCl)CCCl

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)N(CCCl)CCCl

InChI

InChI=1S/C14H19Cl2NO2/c1-19-14(18)7-4-12-2-5-13(6-3-12)17(10-8-15)11-9-16/h2-3,5-6H,4,7-11H2,1H3