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methyl 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxy-benzoate

methyl 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxy-benzoate

Systemtic Name:methyl 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxy-benzoate
Openeye Name:methyl 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxy-benzoate
CAS Name:5-[bis(2-chloroethyl)aminomethyl]-2-ethoxybenzoic acid methyl ester
IUPAC Name:methyl 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxybenzoate
Traditional Name:5-[bis(2-chloroethyl)aminomethyl]-2-ethoxy-benzoic acid methyl ester
Formula: C15H21Cl2NO3
MolecularWeight: 334.23814
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(CCCl)CCCl)C(=O)OC


Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(CCCl)CCCl)C(=O)OC


InChI

InChI=1S/C15H21Cl2NO3/c1-3-21-14-5-4-12(10-13(14)15(19)20-2)11-18(8-6-16)9-7-17/h4-5,10H,3,6-9,11H2,1-2H3


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