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

Systemtic Name: methyl 2-[[4-[bis(2-chloroethyl)amino]phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-[bis(2-chloroethyl)amino]benzoyl]amino]acetate CAS Name: 2-[[[4-[bis(2-chloroethyl)amino]phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[bis(2-chloroethyl)amino]benzoyl]amino]acetate Traditional Name: 2-[[4-[bis(2-chloroethyl)amino]benzoyl]amino]acetic acid methyl ester Formula: C14H18Cl2N2O3 MolecularWeight: 333.21032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18Cl2N2O3/c1-21-13(19)10-17-14(20)11-2-4-12(5-3-11)18(8-6-15)9-7-16/h2-5H,6-10H2,1H3,(H,17,20)