(2R)-N-(1-azanylisoquinolin-6-yl)-2-[4-(4-tert-butylphenyl)-3-oxidanylidene-morpholin-2-yl]-2-oxidanyl-ethanamide

Systemtic Name: (2R)-N-(1-azanylisoquinolin-6-yl)-2-[4-(4-tert-butylphenyl)-3-oxidanylidene-morpholin-2-yl]-2-oxidanyl-ethanamide Openeye Name: (2R)-N-(1-amino-6-isoquinolyl)-2-[4-(4-tert-butylphenyl)-3-oxo-morpholin-2-yl]-2-hydroxy-acetamide CAS Name: (2R)-N-(1-amino-6-isoquinolinyl)-2-[4-(4-tert-butylphenyl)-3-oxo-2-morpholinyl]-2-hydroxyacetamide IUPAC Name: (2R)-N-(1-aminoisoquinolin-6-yl)-2-[4-(4-tert-butylphenyl)-3-oxomorpholin-2-yl]-2-hydroxyacetamide Traditional Name: (2R)-N-(1-amino-6-isoquinolyl)-2-[4-(4-tert-butylphenyl)-3-keto-morpholin-2-yl]-2-hydroxy-acetamide Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CCOC(C2=O)C(C(=O)NC3=CC4=C(C=C3)C(=NC=C4)N)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CCOC(C2=O)[C@H](C(=O)NC3=CC4=C(C=C3)C(=NC=C4)N)O

InChI

InChI=1S/C25H28N4O4/c1-25(2,3)16-4-7-18(8-5-16)29-12-13-33-21(24(29)32)20(30)23(31)28-17-6-9-19-15(14-17)10-11-27-22(19)26/h4-11,14,20-21,30H,12-13H2,1-3H3,(H2,26,27)(H,28,31)/t20-,21?/m1/s1