(2S)-1-[(2R)-2-azanyl-2-cyclohexyl-ethanoyl]-N-[(5-chloranyl-2-oxidanyl-phenyl)methyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(2R)-2-azanyl-2-cyclohexyl-ethanoyl]-N-[(5-chloranyl-2-oxidanyl-phenyl)methyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(2R)-2-amino-2-cyclohexyl-acetyl]-N-[(5-chloro-2-hydroxy-phenyl)methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[(2R)-2-amino-2-cyclohexyl-1-oxoethyl]-N-[(5-chloro-2-hydroxyphenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(2R)-2-amino-2-cyclohexylacetyl]-N-[(5-chloro-2-hydroxyphenyl)methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[(2R)-2-amino-2-cyclohexyl-acetyl]-N-(5-chloro-2-hydroxy-benzyl)pyrrolidine-2-carboxamide Formula: C20H28ClN3O3 MolecularWeight: 393.90762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)N2CCCC2C(=O)NCC3=C(C=CC(=C3)Cl)O)N

Isomeric SMILES

C1CCC(CC1)[C@H](C(=O)N2CCC[C@H]2C(=O)NCC3=C(C=CC(=C3)Cl)O)N

InChI

InChI=1S/C20H28ClN3O3/c21-15-8-9-17(25)14(11-15)12-23-19(26)16-7-4-10-24(16)20(27)18(22)13-5-2-1-3-6-13/h8-9,11,13,16,18,25H,1-7,10,12,22H2,(H,23,26)/t16-,18+/m0/s1