cyclohexyl (4S)-4-benzamido-5-[cyano(methyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: cyclohexyl (4S)-4-benzamido-5-[cyano(methyl)amino]-5-oxidanylidene-pentanoate Openeye Name: cyclohexyl (4S)-4-benzamido-5-[cyano(methyl)amino]-5-oxo-pentanoate CAS Name: (4S)-4-benzamido-5-[cyano(methyl)amino]-5-oxopentanoic acid cyclohexyl ester IUPAC Name: cyclohexyl (4S)-4-benzamido-5-[cyano(methyl)amino]-5-oxopentanoate Traditional Name: (4S)-4-benzamido-5-[cyano(methyl)amino]-5-keto-valeric acid cyclohexyl ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CN(C#N)C(=O)C(CCC(=O)OC1CCCCC1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CN(C#N)C(=O)[C@H](CCC(=O)OC1CCCCC1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H25N3O4/c1-23(14-21)20(26)17(22-19(25)15-8-4-2-5-9-15)12-13-18(24)27-16-10-6-3-7-11-16/h2,4-5,8-9,16-17H,3,6-7,10-13H2,1H3,(H,22,25)/t17-/m0/s1