(2S)-N-(3-acetamido-2-methyl-phenyl)-2-(2-bromanyl-4-chloranyl-phenoxy)propanamide

Systemtic Name: (2S)-N-(3-acetamido-2-methyl-phenyl)-2-(2-bromanyl-4-chloranyl-phenoxy)propanamide Openeye Name: (2S)-N-(3-acetamido-2-methyl-phenyl)-2-(2-bromo-4-chloro-phenoxy)propanamide CAS Name: (2S)-N-(3-acetamido-2-methylphenyl)-2-(2-bromo-4-chlorophenoxy)propanamide IUPAC Name: (2S)-N-(3-acetamido-2-methylphenyl)-2-(2-bromo-4-chlorophenoxy)propanamide Traditional Name: (2S)-N-(3-acetamido-2-methyl-phenyl)-2-(2-bromo-4-chloro-phenoxy)propionamide Formula: C18H18BrClN2O3 MolecularWeight: 425.70412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Br)NC(=O)C

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)[C@H](C)OC2=C(C=C(C=C2)Cl)Br)NC(=O)C

InChI

InChI=1S/C18H18BrClN2O3/c1-10-15(21-12(3)23)5-4-6-16(10)22-18(24)11(2)25-17-8-7-13(20)9-14(17)19/h4-9,11H,1-3H3,(H,21,23)(H,22,24)/t11-/m0/s1