2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-pyrrol-1-ylphenyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-pyrrol-1-ylphenyl)ethanamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-pyrrol-1-ylphenyl)acetamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[2-(1-pyrrolyl)phenyl]acetamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-pyrrol-1-ylphenyl)acetamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-pyrrol-1-ylphenyl)acetamide Formula: C21H21N3O MolecularWeight: 331.41094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(=O)NC3=CC=CC=C3N4C=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(=O)NC3=CC=CC=C3N4C=CC=C4

InChI

InChI=1S/C21H21N3O/c25-21(16-23-14-11-17-7-1-2-8-18(17)15-23)22-19-9-3-4-10-20(19)24-12-5-6-13-24/h1-10,12-13H,11,14-16H2,(H,22,25)