3-azanyl-N-isoquinolin-6-yl-2-phenyl-propanamide

Systemtic Name: 3-azanyl-N-isoquinolin-6-yl-2-phenyl-propanamide Openeye Name: 3-amino-N-(6-isoquinolyl)-2-phenyl-propanamide CAS Name: 3-amino-N-(6-isoquinolinyl)-2-phenylpropanamide IUPAC Name: 3-amino-N-isoquinolin-6-yl-2-phenylpropanamide Traditional Name: 3-amino-N-(6-isoquinolyl)-2-phenyl-propionamide Formula: C18H17N3O MolecularWeight: 291.34708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CN)C(=O)NC2=CC3=C(C=C2)C=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CN)C(=O)NC2=CC3=C(C=C2)C=NC=C3

InChI

InChI=1S/C18H17N3O/c19-11-17(13-4-2-1-3-5-13)18(22)21-16-7-6-15-12-20-9-8-14(15)10-16/h1-10,12,17H,11,19H2,(H,21,22)