3-[4-[2-chloroethyl(ethyl)amino]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-chloroethyl(ethyl)amino]phenyl]propanoic acid Openeye Name: 3-[4-[2-chloroethyl(ethyl)amino]phenyl]propanoic acid CAS Name: 3-[4-[2-chloroethyl(ethyl)amino]phenyl]propanoic acid IUPAC Name: 3-[4-[2-chloroethyl(ethyl)amino]phenyl]propanoic acid Traditional Name: 3-[4-[2-chloroethyl(ethyl)amino]phenyl]propionic acid Formula: C13H18ClNO2 MolecularWeight: 255.74052

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCl)C1=CC=C(C=C1)CCC(=O)O

Isomeric SMILES

CCN(CCCl)C1=CC=C(C=C1)CCC(=O)O

InChI

InChI=1S/C13H18ClNO2/c1-2-15(10-9-14)12-6-3-11(4-7-12)5-8-13(16)17/h3-4,6-7H,2,5,8-10H2,1H3,(H,16,17)