(2-chloranyl-6-fluoranyl-phenyl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propanoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propionic acid (2-chloro-6-fluoro-benzyl) ester Formula: C20H18ClFN2O3 MolecularWeight: 388.819923

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H18ClFN2O3/c1-12(25)24-19(9-13-10-23-18-8-3-2-5-14(13)18)20(26)27-11-15-16(21)6-4-7-17(15)22/h2-8,10,19,23H,9,11H2,1H3,(H,24,25)/t19-/m0/s1