(2S)-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-phenoxy-propanamide

Systemtic Name: (2S)-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-phenoxy-propanamide Openeye Name: (2S)-N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-2-phenoxy-propanamide CAS Name: (2S)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-phenoxypropanamide IUPAC Name: (2S)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-phenoxypropanamide Traditional Name: (2S)-N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-2-phenoxy-propionamide Formula: C18H19BrN2O3 MolecularWeight: 391.25906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C(C)OC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)[C@H](C)OC2=CC=CC=C2

InChI

InChI=1S/C18H19BrN2O3/c1-12-10-14(19)8-9-16(12)21-17(22)11-20-18(23)13(2)24-15-6-4-3-5-7-15/h3-10,13H,11H2,1-2H3,(H,20,23)(H,21,22)/t13-/m0/s1