methyl (2R,3S)-2-[2-(2-chloranyl-4-cyano-phenoxy)ethanoylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2R,3S)-2-[2-(2-chloranyl-4-cyano-phenoxy)ethanoylamino]-3-methyl-pentanoate Openeye Name: methyl (2R,3S)-2-[[2-(2-chloro-4-cyano-phenoxy)acetyl]amino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[2-(2-chloro-4-cyanophenoxy)-1-oxoethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-[[2-(2-chloro-4-cyanophenoxy)acetyl]amino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[2-(2-chloro-4-cyano-phenoxy)acetyl]amino]-3-methyl-valeric acid methyl ester Formula: C16H19ClN2O4 MolecularWeight: 338.78606

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)COC1=C(C=C(C=C1)C#N)Cl

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)OC)NC(=O)COC1=C(C=C(C=C1)C#N)Cl

InChI

InChI=1S/C16H19ClN2O4/c1-4-10(2)15(16(21)22-3)19-14(20)9-23-13-6-5-11(8-18)7-12(13)17/h5-7,10,15H,4,9H2,1-3H3,(H,19,20)/t10-,15+/m0/s1