[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(4-chloranylphenoxy)propanoate

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-(4-chloranylphenoxy)propanoate Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl] (2S)-2-(4-chlorophenoxy)propanoate CAS Name: (2S)-2-(4-chlorophenoxy)propanoic acid [2-(2-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl] (2S)-2-(4-chlorophenoxy)propanoate Traditional Name: (2S)-2-(4-chlorophenoxy)propionic acid [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C18H17BrClNO4 MolecularWeight: 426.68888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrClNO4/c1-11-3-8-16(15(19)9-11)21-17(22)10-24-18(23)12(2)25-14-6-4-13(20)5-7-14/h3-9,12H,10H2,1-2H3,(H,21,22)/t12-/m0/s1