N-ethyl-4-methyl-3-[1-oxidanylidene-7-[2-(4-oxidanylpiperidin-1-yl)ethoxy]isoquinolin-2-yl]benzamide

Systemtic Name: N-ethyl-4-methyl-3-[1-oxidanylidene-7-[2-(4-oxidanylpiperidin-1-yl)ethoxy]isoquinolin-2-yl]benzamide Openeye Name: N-ethyl-3-[7-[2-(4-hydroxy-1-piperidyl)ethoxy]-1-oxo-2-isoquinolyl]-4-methyl-benzamide CAS Name: N-ethyl-3-[7-[2-(4-hydroxy-1-piperidinyl)ethoxy]-1-oxo-2-isoquinolinyl]-4-methylbenzamide IUPAC Name: N-ethyl-3-[7-[2-(4-hydroxypiperidin-1-yl)ethoxy]-1-oxoisoquinolin-2-yl]-4-methylbenzamide Traditional Name: N-ethyl-3-[7-[2-(4-hydroxypiperidino)ethoxy]-1-keto-2-isoquinolyl]-4-methyl-benzamide Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=C(C=C1)C)N2C=CC3=C(C2=O)C=C(C=C3)OCCN4CCC(CC4)O

Isomeric SMILES

CCNC(=O)C1=CC(=C(C=C1)C)N2C=CC3=C(C2=O)C=C(C=C3)OCCN4CCC(CC4)O

InChI

InChI=1S/C26H31N3O4/c1-3-27-25(31)20-5-4-18(2)24(16-20)29-13-8-19-6-7-22(17-23(19)26(29)32)33-15-14-28-11-9-21(30)10-12-28/h4-8,13,16-17,21,30H,3,9-12,14-15H2,1-2H3,(H,27,31)