methyl 3-[bis(2-chloroethyl)amino]benzoate

Systemtic Name: methyl 3-[bis(2-chloroethyl)amino]benzoate Openeye Name: methyl 3-[bis(2-chloroethyl)amino]benzoate CAS Name: 3-[bis(2-chloroethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[bis(2-chloroethyl)amino]benzoate Traditional Name: 3-[bis(2-chloroethyl)amino]benzoic acid methyl ester Formula: C12H15Cl2NO2 MolecularWeight: 276.159

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15Cl2NO2/c1-17-12(16)10-3-2-4-11(9-10)15(7-5-13)8-6-14/h2-4,9H,5-8H2,1H3