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

Systemtic Name: (3R,4R)-3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]carbonylamino]-N-ethyl-4-oxidanyl-azepane-1-carboxamide Openeye Name: (3R,4R)-3-[[4-(2-amino-2-oxo-ethoxy)benzoyl]amino]-N-ethyl-4-hydroxy-azepane-1-carboxamide CAS Name: (3R,4R)-3-[[[4-(2-amino-2-oxoethoxy)phenyl]-oxomethyl]amino]-N-ethyl-4-hydroxy-1-azepanecarboxamide IUPAC Name: (3R,4R)-3-[[4-(2-amino-2-oxoethoxy)benzoyl]amino]-N-ethyl-4-hydroxyazepane-1-carboxamide Traditional Name: (3R,4R)-3-[[4-(2-amino-2-keto-ethoxy)benzoyl]amino]-N-ethyl-4-hydroxy-azepane-1-carboxamide Formula: C18H26N4O5 MolecularWeight: 378.42284

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCCC(C(C1)NC(=O)C2=CC=C(C=C2)OCC(=O)N)O

Isomeric SMILES

CCNC(=O)N1CCC[C@H]([C@@H](C1)NC(=O)C2=CC=C(C=C2)OCC(=O)N)O

InChI

InChI=1S/C18H26N4O5/c1-2-20-18(26)22-9-3-4-15(23)14(10-22)21-17(25)12-5-7-13(8-6-12)27-11-16(19)24/h5-8,14-15,23H,2-4,9-11H2,1H3,(H2,19,24)(H,20,26)(H,21,25)/t14-,15-/m1/s1