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

Systemtic Name: 2-diethylaminoethyl 3-[bis(2-chloroethyl)amino]benzoate Openeye Name: 2-diethylaminoethyl 3-[bis(2-chloroethyl)amino]benzoate CAS Name: 3-[bis(2-chloroethyl)amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 3-[bis(2-chloroethyl)amino]benzoate Traditional Name: 3-[bis(2-chloroethyl)amino]benzoic acid 2-diethylaminoethyl ester Formula: C17H26Cl2N2O2 MolecularWeight: 361.30654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26Cl2N2O2/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