N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclobutanecarboxamide

Systemtic Name: N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclobutanecarboxamide Openeye Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclobutanecarboxamide CAS Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclobutanecarboxamide IUPAC Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclobutanecarboxamide Traditional Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclobutanecarboxamide Formula: C21H22N2O2 MolecularWeight: 334.41158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

C1CC(C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C21H22N2O2/c24-20(16-7-4-8-16)22-19-10-9-15-11-12-23(14-18(15)13-19)21(25)17-5-2-1-3-6-17/h1-3,5-6,9-10,13,16H,4,7-8,11-12,14H2,(H,22,24)