(4-bromanyl-2-chloranyl-6-methyl-phenyl) (2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoate

Systemtic Name: (4-bromanyl-2-chloranyl-6-methyl-phenyl) (2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: (4-bromo-2-chloro-6-methyl-phenyl) (2S)-2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: (2S)-2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid (4-bromo-2-chloro-6-methylphenyl) ester IUPAC Name: (4-bromo-2-chloro-6-methylphenyl) (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: (2S)-2-(2-furoylamino)-3-methyl-butyric acid (4-bromo-2-chloro-6-methyl-phenyl) ester Formula: C17H17BrClNO4 MolecularWeight: 414.67818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C(C(C)C)NC(=O)C2=CC=CO2)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)[C@H](C(C)C)NC(=O)C2=CC=CO2)Cl)Br

InChI

InChI=1S/C17H17BrClNO4/c1-9(2)14(20-16(21)13-5-4-6-23-13)17(22)24-15-10(3)7-11(18)8-12(15)19/h4-9,14H,1-3H3,(H,20,21)/t14-/m0/s1