N-[3-azanyl-2-(2-methoxyethyl)-1-oxidanylidene-4-phenyl-isoquinolin-7-yl]-2-methyl-benzamide

Systemtic Name: N-[3-azanyl-2-(2-methoxyethyl)-1-oxidanylidene-4-phenyl-isoquinolin-7-yl]-2-methyl-benzamide Openeye Name: N-[3-amino-2-(2-methoxyethyl)-1-oxo-4-phenyl-7-isoquinolyl]-2-methyl-benzamide CAS Name: N-[3-amino-2-(2-methoxyethyl)-1-oxo-4-phenyl-7-isoquinolinyl]-2-methylbenzamide IUPAC Name: N-[3-amino-2-(2-methoxyethyl)-1-oxo-4-phenylisoquinolin-7-yl]-2-methylbenzamide Traditional Name: N-[3-amino-1-keto-2-(2-methoxyethyl)-4-phenyl-7-isoquinolyl]-2-methyl-benzamide Formula: C26H25N3O3 MolecularWeight: 427.495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)C(=C(N(C3=O)CCOC)N)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)C(=C(N(C3=O)CCOC)N)C4=CC=CC=C4

InChI

InChI=1S/C26H25N3O3/c1-17-8-6-7-11-20(17)25(30)28-19-12-13-21-22(16-19)26(31)29(14-15-32-2)24(27)23(21)18-9-4-3-5-10-18/h3-13,16H,14-15,27H2,1-2H3,(H,28,30)