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

Systemtic Name: 4-tert-butyl-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-tert-butyl-benzamide CAS Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-tert-butylbenzamide IUPAC Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-tert-butylbenzamide Traditional Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-tert-butyl-benzamide Formula: C27H28N2O2 MolecularWeight: 412.52342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O2/c1-27(2,3)23-12-9-20(10-13-23)25(30)28-24-14-11-19-15-16-29(18-22(19)17-24)26(31)21-7-5-4-6-8-21/h4-14,17H,15-16,18H2,1-3H3,(H,28,30)