[(2S)-1-(cyanoamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl] 2-(hydroxymethyl)pyrrolidine-1-carboxylate

Systemtic Name: [(2S)-1-(cyanoamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl] 2-(hydroxymethyl)pyrrolidine-1-carboxylate Openeye Name: [(1S)-2-(cyanoamino)-1-(cyclohexylmethyl)-2-oxo-ethyl] 2-(hydroxymethyl)pyrrolidine-1-carboxylate CAS Name: 2-(hydroxymethyl)-1-pyrrolidinecarboxylic acid [(2S)-1-(cyanoamino)-3-cyclohexyl-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyanoamino)-3-cyclohexyl-1-oxopropan-2-yl] 2-(hydroxymethyl)pyrrolidine-1-carboxylate Traditional Name: 2-methylolpyrrolidine-1-carboxylic acid [(1S)-2-(cyanoamino)-1-(cyclohexylmethyl)-2-keto-ethyl] ester Formula: C16H25N3O4 MolecularWeight: 323.3874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC#N)OC(=O)N2CCCC2CO

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=O)NC#N)OC(=O)N2CCCC2CO

InChI

InChI=1S/C16H25N3O4/c17-11-18-15(21)14(9-12-5-2-1-3-6-12)23-16(22)19-8-4-7-13(19)10-20/h12-14,20H,1-10H2,(H,18,21)/t13?,14-/m0/s1