5-phenyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-1,3-oxazole-2-carboxamide

Systemtic Name: 5-phenyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-1,3-oxazole-2-carboxamide Openeye Name: 5-phenyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxazole-2-carboxamide CAS Name: N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-phenyl-2-oxazolecarboxamide IUPAC Name: 5-phenyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-1,3-oxazole-2-carboxamide Traditional Name: 5-phenyl-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)oxazole-2-carboxamide Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=NC=C(O3)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=NC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3/c1-2-20(26)25-11-10-15-8-9-18(12-17(15)14-25)24-21(27)22-23-13-19(28-22)16-6-4-3-5-7-16/h3-9,12-13H,2,10-11,14H2,1H3,(H,24,27)