benzoic acid; 2-chloranyl-N-(2-chloroethyl)ethanamine

Systemtic Name: benzoic acid; 2-chloranyl-N-(2-chloroethyl)ethanamine Openeye Name: benzoic acid; 2-chloro-N-(2-chloroethyl)ethanamine CAS Name: benzoic acid; 2-chloro-N-(2-chloroethyl)ethanamine IUPAC Name: benzoic acid; 2-chloro-N-(2-chloroethyl)ethanamine Traditional Name: benzoic acid; bis(2-chloroethyl)amine Formula: C11H15Cl2NO2 MolecularWeight: 264.1483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)O.C(CCl)NCCCl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)O.C(CCl)NCCCl

InChI

InChI=1S/C7H6O2.C4H9Cl2N/c8-7(9)6-4-2-1-3-5-6;5-1-3-7-4-2-6/h1-5H,(H,8,9);7H,1-4H2