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

Systemtic Name: methyl (2R)-2-azanyl-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate Openeye Name: methyl (2R)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate CAS Name: (2R)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate Traditional Name: (2R)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propionic acid methyl ester Formula: C14H20Cl2N2O2 MolecularWeight: 319.2268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)[C@@H](CC1=CC=C(C=C1)N(CCCl)CCCl)N

InChI

InChI=1S/C14H20Cl2N2O2/c1-20-14(19)13(17)10-11-2-4-12(5-3-11)18(8-6-15)9-7-16/h2-5,13H,6-10,17H2,1H3/t13-/m1/s1