4-[2-[2-(2-methoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxyethanoylamino]benzamide

Systemtic Name: 4-[2-[2-(2-methoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxyethanoylamino]benzamide Openeye Name: 4-[[2-[[2-(2-methoxyethyl)-1-oxo-5-isoquinolyl]oxy]acetyl]amino]benzamide CAS Name: 4-[[2-[[2-(2-methoxyethyl)-1-oxo-5-isoquinolinyl]oxy]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[2-(2-methoxyethyl)-1-oxoisoquinolin-5-yl]oxyacetyl]amino]benzamide Traditional Name: 4-[[2-[[1-keto-2-(2-methoxyethyl)-5-isoquinolyl]oxy]acetyl]amino]benzamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

COCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H21N3O5/c1-28-12-11-24-10-9-16-17(21(24)27)3-2-4-18(16)29-13-19(25)23-15-7-5-14(6-8-15)20(22)26/h2-10H,11-13H2,1H3,(H2,22,26)(H,23,25)