2-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide

Systemtic Name: 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide Openeye Name: 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide CAS Name: 2-(2-oxo-1,3-benzoxazol-3-yl)-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide IUPAC Name: 2-(2-oxo-1,3-benzoxazol-3-yl)-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide Traditional Name: 2-(2-keto-1,3-benzoxazol-3-yl)-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)CN3C4=CC=CC=C4OC3=O

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)CN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H21N3O4/c1-2-20(26)23-10-9-14-7-8-16(11-15(14)12-23)22-19(25)13-24-17-5-3-4-6-18(17)28-21(24)27/h3-8,11H,2,9-10,12-13H2,1H3,(H,22,25)