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2-diethylaminoethyl 3-[bis(2-chloroethyl)amino]benzoate hydrochloride

2-diethylaminoethyl 3-[bis(2-chloroethyl)amino]benzoate hydrochloride

Systemtic Name:2-diethylaminoethyl 3-[bis(2-chloroethyl)amino]benzoate hydrochloride
Openeye Name:2-diethylaminoethyl 3-[bis(2-chloroethyl)amino]benzoate hydrochloride
CAS Name:3-[bis(2-chloroethyl)amino]benzoic acid 2-diethylaminoethyl ester hydrochloride
IUPAC Name:2-diethylaminoethyl 3-[bis(2-chloroethyl)amino]benzoate hydrochloride
Traditional Name:3-[bis(2-chloroethyl)amino]benzoic acid 2-diethylaminoethyl ester hydrochloride
Formula: C17H27Cl3N2O2
MolecularWeight: 397.76748
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC(=CC=C1)N(CCCl)CCCl.Cl


Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC(=CC=C1)N(CCCl)CCCl.Cl


InChI

InChI=1S/C17H26Cl2N2O2.ClH/c1-3-20(4-2)12-13-23-17(22)15-6-5-7-16(14-15)21(10-8-18)11-9-19;/h5-7,14H,3-4,8-13H2,1-2H3;1H


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