7-(2-azanylethylamino)-3-phenyl-2H-isoquinolin-1-one

Systemtic Name: 7-(2-azanylethylamino)-3-phenyl-2H-isoquinolin-1-one Openeye Name: 7-(2-aminoethylamino)-3-phenyl-2H-isoquinolin-1-one CAS Name: 7-(2-aminoethylamino)-3-phenyl-2H-isoquinolin-1-one IUPAC Name: 7-(2-aminoethylamino)-3-phenyl-2H-isoquinolin-1-one Traditional Name: 7-(2-aminoethylamino)-3-phenyl-isocarbostyril Formula: C17H17N3O MolecularWeight: 279.33638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)NCCN)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)NCCN)C(=O)N2

InChI

InChI=1S/C17H17N3O/c18-8-9-19-14-7-6-13-10-16(12-4-2-1-3-5-12)20-17(21)15(13)11-14/h1-7,10-11,19H,8-9,18H2,(H,20,21)