4-bromanyl-N-isoquinolin-1-yl-N-(4-methoxyphenyl)benzamide

Systemtic Name: 4-bromanyl-N-isoquinolin-1-yl-N-(4-methoxyphenyl)benzamide Openeye Name: 4-bromo-N-(1-isoquinolyl)-N-(4-methoxyphenyl)benzamide CAS Name: 4-bromo-N-(1-isoquinolinyl)-N-(4-methoxyphenyl)benzamide IUPAC Name: 4-bromo-N-isoquinolin-1-yl-N-(4-methoxyphenyl)benzamide Traditional Name: 4-bromo-N-(1-isoquinolyl)-N-(4-methoxyphenyl)benzamide Formula: C23H17BrN2O2 MolecularWeight: 433.29728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(C2=NC=CC3=CC=CC=C32)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)N(C2=NC=CC3=CC=CC=C32)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H17BrN2O2/c1-28-20-12-10-19(11-13-20)26(23(27)17-6-8-18(24)9-7-17)22-21-5-3-2-4-16(21)14-15-25-22/h2-15H,1H3