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

Systemtic Name: 2-benzamido-3-[4-[2-chloroethyl(2-fluoranylethyl)amino]phenyl]propanoic acid Openeye Name: 2-benzamido-3-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]propanoic acid CAS Name: 2-benzamido-3-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]propanoic acid IUPAC Name: 2-benzamido-3-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]propanoic acid Traditional Name: 2-benzamido-3-[4-[2-chloroethyl(2-fluoroethyl)amino]phenyl]propionic acid Formula: C20H22ClFN2O3 MolecularWeight: 392.851683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)N(CCF)CCCl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)N(CCF)CCCl)C(=O)O

InChI

InChI=1S/C20H22ClFN2O3/c21-10-12-24(13-11-22)17-8-6-15(7-9-17)14-18(20(26)27)23-19(25)16-4-2-1-3-5-16/h1-9,18H,10-14H2,(H,23,25)(H,26,27)