4-ethyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide

Systemtic Name: 4-ethyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Openeye Name: 4-ethyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide CAS Name: 4-ethyl-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 4-ethyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Traditional Name: 4-ethyl-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)CC)C=C2

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)CC)C=C2

InChI

InChI=1S/C21H24N2O2/c1-3-15-5-7-17(8-6-15)21(25)22-19-10-9-16-11-12-23(20(24)4-2)14-18(16)13-19/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,22,25)