methyl 2-[[(2S)-2-chloranyl-3-oxidanylidene-hex-5-enyl]-[(1R)-1-phenylethyl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: methyl 2-[[(2S)-2-chloranyl-3-oxidanylidene-hex-5-enyl]-[(1R)-1-phenylethyl]amino]-2-oxidanylidene-ethanoate Openeye Name: methyl 2-[[(2S)-2-chloro-3-oxo-hex-5-enyl]-[(1R)-1-phenylethyl]amino]-2-oxo-acetate CAS Name: 2-[[(2S)-2-chloro-3-oxohex-5-enyl]-[(1R)-1-phenylethyl]amino]-2-oxoacetic acid methyl ester IUPAC Name: methyl 2-[[(2S)-2-chloro-3-oxohex-5-enyl]-[(1R)-1-phenylethyl]amino]-2-oxoacetate Traditional Name: 2-[[(2S)-2-chloro-3-keto-hex-5-enyl]-[(1R)-1-phenylethyl]amino]-2-keto-acetic acid methyl ester Formula: C17H20ClNO4 MolecularWeight: 337.798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC(C(=O)CC=C)Cl)C(=O)C(=O)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N(C[C@@H](C(=O)CC=C)Cl)C(=O)C(=O)OC

InChI

InChI=1S/C17H20ClNO4/c1-4-8-15(20)14(18)11-19(16(21)17(22)23-3)12(2)13-9-6-5-7-10-13/h4-7,9-10,12,14H,1,8,11H2,2-3H3/t12-,14+/m1/s1