3,5-bis[bis(2-chloroethyl)amino]benzoic acid

Systemtic Name: 3,5-bis[bis(2-chloroethyl)amino]benzoic acid Openeye Name: 3,5-bis[bis(2-chloroethyl)amino]benzoic acid CAS Name: 3,5-bis[bis(2-chloroethyl)amino]benzoic acid IUPAC Name: 3,5-bis[bis(2-chloroethyl)amino]benzoic acid Traditional Name: 3,5-bis[bis(2-chloroethyl)amino]benzoic acid Formula: C15H20Cl4N2O2 MolecularWeight: 402.1435

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1N(CCCl)CCCl)N(CCCl)CCCl)C(=O)O

Isomeric SMILES

C1=C(C=C(C=C1N(CCCl)CCCl)N(CCCl)CCCl)C(=O)O

InChI

InChI=1S/C15H20Cl4N2O2/c16-1-5-20(6-2-17)13-9-12(15(22)23)10-14(11-13)21(7-3-18)8-4-19/h9-11H,1-8H2,(H,22,23)