3-[(2-chloranyl-6-fluoranyl-phenyl)methyl-[(3-methylphenyl)methyl]amino]propanoic acid

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl-[(3-methylphenyl)methyl]amino]propanoic acid Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methyl-(m-tolylmethyl)amino]propanoic acid CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl-[(3-methylphenyl)methyl]amino]propanoic acid IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methyl-[(3-methylphenyl)methyl]amino]propanoic acid Traditional Name: 3-[(2-chloro-6-fluoro-benzyl)-(3-methylbenzyl)amino]propionic acid Formula: C18H19ClFNO2 MolecularWeight: 335.800363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN(CCC(=O)O)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

CC1=CC(=CC=C1)CN(CCC(=O)O)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C18H19ClFNO2/c1-13-4-2-5-14(10-13)11-21(9-8-18(22)23)12-15-16(19)6-3-7-17(15)20/h2-7,10H,8-9,11-12H2,1H3,(H,22,23)