ethyl 5-[bis(2-chloroethyl)amino]-2-propanoyloxy-benzoate

Systemtic Name: ethyl 5-[bis(2-chloroethyl)amino]-2-propanoyloxy-benzoate Openeye Name: ethyl 5-[bis(2-chloroethyl)amino]-2-propanoyloxy-benzoate CAS Name: 5-[bis(2-chloroethyl)amino]-2-(1-oxopropoxy)benzoic acid ethyl ester IUPAC Name: ethyl 5-[bis(2-chloroethyl)amino]-2-propanoyloxybenzoate Traditional Name: 5-[bis(2-chloroethyl)amino]-2-propionyloxy-benzoic acid ethyl ester Formula: C16H21Cl2NO4 MolecularWeight: 362.24824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C=C(C=C1)N(CCCl)CCCl)C(=O)OCC

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1)N(CCCl)CCCl)C(=O)OCC

InChI

InChI=1S/C16H21Cl2NO4/c1-3-15(20)23-14-6-5-12(19(9-7-17)10-8-18)11-13(14)16(21)22-4-2/h5-6,11H,3-4,7-10H2,1-2H3