2-[4-[bis(1-chloroethyl)amino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[bis(1-chloroethyl)amino]phenyl]ethanoic acid Openeye Name: 2-[4-[bis(1-chloroethyl)amino]phenyl]acetic acid CAS Name: 2-[4-[bis(1-chloroethyl)amino]phenyl]acetic acid IUPAC Name: 2-[4-[bis(1-chloroethyl)amino]phenyl]acetic acid Traditional Name: 2-[4-[bis(1-chloroethyl)amino]phenyl]acetic acid Formula: C12H15Cl2NO2 MolecularWeight: 276.159

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Descriptors Computed from Structure

Canonical SMILES:

CC(N(C1=CC=C(C=C1)CC(=O)O)C(C)Cl)Cl

Isomeric SMILES

CC(N(C1=CC=C(C=C1)CC(=O)O)C(C)Cl)Cl

InChI

InChI=1S/C12H15Cl2NO2/c1-8(13)15(9(2)14)11-5-3-10(4-6-11)7-12(16)17/h3-6,8-9H,7H2,1-2H3,(H,16,17)