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

Systemtic Name: 4-[2-[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxyethanoylamino]benzamide Openeye Name: 4-[[2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolyl]oxy]acetyl]amino]benzamide CAS Name: 4-[[2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolinyl]oxy]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[2-(2-ethoxyethyl)-1-oxoisoquinolin-5-yl]oxyacetyl]amino]benzamide Traditional Name: 4-[[2-[[2-(2-ethoxyethyl)-1-keto-5-isoquinolyl]oxy]acetyl]amino]benzamide Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C22H23N3O5/c1-2-29-13-12-25-11-10-17-18(22(25)28)4-3-5-19(17)30-14-20(26)24-16-8-6-15(7-9-16)21(23)27/h3-11H,2,12-14H2,1H3,(H2,23,27)(H,24,26)