4-methyl-N-(3-morpholin-4-ylphenyl)-3-(1-oxidanylidene-2H-isoquinolin-7-yl)benzamide

Systemtic Name: 4-methyl-N-(3-morpholin-4-ylphenyl)-3-(1-oxidanylidene-2H-isoquinolin-7-yl)benzamide Openeye Name: 4-methyl-N-(3-morpholinophenyl)-3-(1-oxo-2H-isoquinolin-7-yl)benzamide CAS Name: 4-methyl-N-[3-(4-morpholinyl)phenyl]-3-(1-oxo-2H-isoquinolin-7-yl)benzamide IUPAC Name: 4-methyl-N-(3-morpholin-4-ylphenyl)-3-(1-oxo-2H-isoquinolin-7-yl)benzamide Traditional Name: 3-(1-keto-2H-isoquinolin-7-yl)-4-methyl-N-(3-morpholinophenyl)benzamide Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)N3CCOCC3)C4=CC5=C(C=C4)C=CNC5=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)N3CCOCC3)C4=CC5=C(C=C4)C=CNC5=O

InChI

InChI=1S/C27H25N3O3/c1-18-5-6-21(16-24(18)20-8-7-19-9-10-28-27(32)25(19)15-20)26(31)29-22-3-2-4-23(17-22)30-11-13-33-14-12-30/h2-10,15-17H,11-14H2,1H3,(H,28,32)(H,29,31)