N-tert-butyl-3-(2-oxidanyl-3-phenyl-butanoyl)pyrrolidine-2-carboxamide; 2-isoquinolin-5-yloxyethanamide; 2-methylbutanamide

Systemtic Name: N-tert-butyl-3-(2-oxidanyl-3-phenyl-butanoyl)pyrrolidine-2-carboxamide; 2-isoquinolin-5-yloxyethanamide; 2-methylbutanamide Openeye Name: N-tert-butyl-3-(2-hydroxy-3-phenyl-butanoyl)pyrrolidine-2-carboxamide; 2-(5-isoquinolyloxy)acetamide; 2-methylbutanamide CAS Name: N-tert-butyl-3-(2-hydroxy-1-oxo-3-phenylbutyl)-2-pyrrolidinecarboxamide; 2-(5-isoquinolinyloxy)acetamide; 2-methylbutanamide IUPAC Name: N-tert-butyl-3-(2-hydroxy-3-phenylbutanoyl)pyrrolidine-2-carboxamide; 2-isoquinolin-5-yloxyacetamide; 2-methylbutanamide Traditional Name: N-tert-butyl-3-(2-hydroxy-3-phenyl-butanoyl)pyrrolidine-2-carboxamide; 2-(5-isoquinolyloxy)acetamide; 2-methylbutyramide Formula: C35H49N5O6 MolecularWeight: 635.79346

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N.CC(C1=CC=CC=C1)C(C(=O)C2CCNC2C(=O)NC(C)(C)C)O.C1=CC2=C(C=CN=C2)C(=C1)OCC(=O)N

Isomeric SMILES

CCC(C)C(=O)N.CC(C1=CC=CC=C1)C(C(=O)C2CCNC2C(=O)NC(C)(C)C)O.C1=CC2=C(C=CN=C2)C(=C1)OCC(=O)N

InChI

InChI=1S/C19H28N2O3.C11H10N2O2.C5H11NO/c1-12(13-8-6-5-7-9-13)16(22)17(23)14-10-11-20-15(14)18(24)21-19(2,3)4;12-11(14)7-15-10-3-1-2-8-6-13-5-4-9(8)10;1-3-4(2)5(6)7/h5-9,12,14-16,20,22H,10-11H2,1-4H3,(H,21,24);1-6H,7H2,(H2,12,14);4H,3H2,1-2H3,(H2,6,7)