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

Systemtic Name: N-[3-azanyl-2-(2-methoxyethyl)-1-oxidanylidene-4-phenyl-isoquinolin-7-yl]-4-methoxy-benzamide Openeye Name: N-[3-amino-2-(2-methoxyethyl)-1-oxo-4-phenyl-7-isoquinolyl]-4-methoxy-benzamide CAS Name: N-[3-amino-2-(2-methoxyethyl)-1-oxo-4-phenyl-7-isoquinolinyl]-4-methoxybenzamide IUPAC Name: N-[3-amino-2-(2-methoxyethyl)-1-oxo-4-phenylisoquinolin-7-yl]-4-methoxybenzamide Traditional Name: N-[3-amino-1-keto-2-(2-methoxyethyl)-4-phenyl-7-isoquinolyl]-4-methoxy-benzamide Formula: C26H25N3O4 MolecularWeight: 443.4944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=C(C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4)N

Isomeric SMILES

COCCN1C(=C(C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4)N

InChI

InChI=1S/C26H25N3O4/c1-32-15-14-29-24(27)23(17-6-4-3-5-7-17)21-13-10-19(16-22(21)26(29)31)28-25(30)18-8-11-20(33-2)12-9-18/h3-13,16H,14-15,27H2,1-2H3,(H,28,30)