(3R,4R)-3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]carbonylamino]-N-cyclohexyl-4-oxidanyl-azepane-1-carboxamide

Systemtic Name: (3R,4R)-3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]carbonylamino]-N-cyclohexyl-4-oxidanyl-azepane-1-carboxamide Openeye Name: (3R,4R)-3-[[4-(2-amino-2-oxo-ethoxy)benzoyl]amino]-N-cyclohexyl-4-hydroxy-azepane-1-carboxamide CAS Name: (3R,4R)-3-[[[4-(2-amino-2-oxoethoxy)phenyl]-oxomethyl]amino]-N-cyclohexyl-4-hydroxy-1-azepanecarboxamide IUPAC Name: (3R,4R)-3-[[4-(2-amino-2-oxoethoxy)benzoyl]amino]-N-cyclohexyl-4-hydroxyazepane-1-carboxamide Traditional Name: (3R,4R)-3-[[4-(2-amino-2-keto-ethoxy)benzoyl]amino]-N-cyclohexyl-4-hydroxy-azepane-1-carboxamide Formula: C22H32N4O5 MolecularWeight: 432.51328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCCC(C(C2)NC(=O)C3=CC=C(C=C3)OCC(=O)N)O

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCC[C@H]([C@@H](C2)NC(=O)C3=CC=C(C=C3)OCC(=O)N)O

InChI

InChI=1S/C22H32N4O5/c23-20(28)14-31-17-10-8-15(9-11-17)21(29)25-18-13-26(12-4-7-19(18)27)22(30)24-16-5-2-1-3-6-16/h8-11,16,18-19,27H,1-7,12-14H2,(H2,23,28)(H,24,30)(H,25,29)/t18-,19-/m1/s1