[(2R)-1-[(2-bromanyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methylphenoxy)propanoate

Systemtic Name: [(2R)-1-[(2-bromanyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-methylphenoxy)propanoate Openeye Name: [(1R)-2-(2-bromo-4-methyl-anilino)-1-methyl-2-oxo-ethyl] 3-(4-methylphenoxy)propanoate CAS Name: 3-(4-methylphenoxy)propanoic acid [(2R)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl] 3-(4-methylphenoxy)propanoate Traditional Name: 3-(4-methylphenoxy)propionic acid [(1R)-2-(2-bromo-4-methyl-anilino)-2-keto-1-methyl-ethyl] ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCC(=O)OC(C)C(=O)NC2=C(C=C(C=C2)C)Br

Isomeric SMILES

CC1=CC=C(C=C1)OCCC(=O)O[C@H](C)C(=O)NC2=C(C=C(C=C2)C)Br

InChI

InChI=1S/C20H22BrNO4/c1-13-4-7-16(8-5-13)25-11-10-19(23)26-15(3)20(24)22-18-9-6-14(2)12-17(18)21/h4-9,12,15H,10-11H2,1-3H3,(H,22,24)/t15-/m1/s1