pentyl 2-[4-(6-chloranyl-4H-quinoxalin-1-yl)-2-oxidanyl-phenoxy]propanoate

Systemtic Name: pentyl 2-[4-(6-chloranyl-4H-quinoxalin-1-yl)-2-oxidanyl-phenoxy]propanoate Openeye Name: pentyl 2-[4-(6-chloro-4H-quinoxalin-1-yl)-2-hydroxy-phenoxy]propanoate CAS Name: 2-[4-(6-chloro-4H-quinoxalin-1-yl)-2-hydroxyphenoxy]propanoic acid pentyl ester IUPAC Name: pentyl 2-[4-(6-chloro-4H-quinoxalin-1-yl)-2-hydroxyphenoxy]propanoate Traditional Name: 2-[4-(6-chloro-4H-quinoxalin-1-yl)-2-hydroxy-phenoxy]propionic acid amyl ester Formula: C22H25ClN2O4 MolecularWeight: 416.8979

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(C)OC1=C(C=C(C=C1)N2C=CNC3=C2C=CC(=C3)Cl)O

Isomeric SMILES

CCCCCOC(=O)C(C)OC1=C(C=C(C=C1)N2C=CNC3=C2C=CC(=C3)Cl)O

InChI

InChI=1S/C22H25ClN2O4/c1-3-4-5-12-28-22(27)15(2)29-21-9-7-17(14-20(21)26)25-11-10-24-18-13-16(23)6-8-19(18)25/h6-11,13-15,24,26H,3-5,12H2,1-2H3