3-[4-[bis(2-chloranylpropyl)amino]phenyl]propanoic acid

Systemtic Name: 3-[4-[bis(2-chloranylpropyl)amino]phenyl]propanoic acid Openeye Name: 3-[4-[bis(2-chloropropyl)amino]phenyl]propanoic acid CAS Name: 3-[4-[bis(2-chloropropyl)amino]phenyl]propanoic acid IUPAC Name: 3-[4-[bis(2-chloropropyl)amino]phenyl]propanoic acid Traditional Name: 3-[4-[bis(2-chloropropyl)amino]phenyl]propionic acid Formula: C15H21Cl2NO2 MolecularWeight: 318.23874

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC(C)Cl)C1=CC=C(C=C1)CCC(=O)O)Cl

Isomeric SMILES

CC(CN(CC(C)Cl)C1=CC=C(C=C1)CCC(=O)O)Cl

InChI

InChI=1S/C15H21Cl2NO2/c1-11(16)9-18(10-12(2)17)14-6-3-13(4-7-14)5-8-15(19)20/h3-4,6-7,11-12H,5,8-10H2,1-2H3,(H,19,20)