4-butoxy-N-[2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-1-oxidanylidene-isoquinolin-7-yl]benzamide

Systemtic Name: 4-butoxy-N-[2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-1-oxidanylidene-isoquinolin-7-yl]benzamide Openeye Name: 4-butoxy-N-[2-(2-morpholino-2-oxo-ethyl)-1-oxo-7-isoquinolyl]benzamide CAS Name: 4-butoxy-N-[2-[2-(4-morpholinyl)-2-oxoethyl]-1-oxo-7-isoquinolinyl]benzamide IUPAC Name: 4-butoxy-N-[2-(2-morpholin-4-yl-2-oxoethyl)-1-oxoisoquinolin-7-yl]benzamide Traditional Name: 4-butoxy-N-[1-keto-2-(2-keto-2-morpholino-ethyl)-7-isoquinolyl]benzamide Formula: C26H29N3O5 MolecularWeight: 463.52556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)C=CN(C3=O)CC(=O)N4CCOCC4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)C=CN(C3=O)CC(=O)N4CCOCC4

InChI

InChI=1S/C26H29N3O5/c1-2-3-14-34-22-8-5-20(6-9-22)25(31)27-21-7-4-19-10-11-29(26(32)23(19)17-21)18-24(30)28-12-15-33-16-13-28/h4-11,17H,2-3,12-16,18H2,1H3,(H,27,31)