methyl 3-[[(2S)-2-(2-bromanyl-4-chloranyl-phenoxy)propanoyl]amino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[(2S)-2-(2-bromanyl-4-chloranyl-phenoxy)propanoyl]amino]-4-methyl-benzoate Openeye Name: methyl 3-[[(2S)-2-(2-bromo-4-chloro-phenoxy)propanoyl]amino]-4-methyl-benzoate CAS Name: 3-[[(2S)-2-(2-bromo-4-chlorophenoxy)-1-oxopropyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[(2S)-2-(2-bromo-4-chlorophenoxy)propanoyl]amino]-4-methylbenzoate Traditional Name: 3-[[(2S)-2-(2-bromo-4-chloro-phenoxy)propanoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C18H17BrClNO4 MolecularWeight: 426.68888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrClNO4/c1-10-4-5-12(18(23)24-3)8-15(10)21-17(22)11(2)25-16-7-6-13(20)9-14(16)19/h4-9,11H,1-3H3,(H,21,22)/t11-/m0/s1