methyl (4S)-4-[2,2,2-tris(chloranyl)ethanoylamino]hex-5-enoate

Systemtic Name: methyl (4S)-4-[2,2,2-tris(chloranyl)ethanoylamino]hex-5-enoate Openeye Name: methyl (4S)-4-[(2,2,2-trichloroacetyl)amino]hex-5-enoate CAS Name: (4S)-4-[(2,2,2-trichloro-1-oxoethyl)amino]-5-hexenoic acid methyl ester IUPAC Name: methyl (4S)-4-[(2,2,2-trichloroacetyl)amino]hex-5-enoate Traditional Name: (4S)-4-[(2,2,2-trichloroacetyl)amino]hex-5-enoic acid methyl ester Formula: C9H12Cl3NO3 MolecularWeight: 288.55548

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C=C)NC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

COC(=O)CC[C@@H](C=C)NC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C9H12Cl3NO3/c1-3-6(4-5-7(14)16-2)13-8(15)9(10,11)12/h3,6H,1,4-5H2,2H3,(H,13,15)/t6-/m1/s1