2-ethoxycarbonyl-3-(4-fluorophenyl)-N-methyl-6-(2-morpholin-4-ylethoxy)inden-1-imine oxide

Systemtic Name: 2-ethoxycarbonyl-3-(4-fluorophenyl)-N-methyl-6-(2-morpholin-4-ylethoxy)inden-1-imine oxide Openeye Name: 2-ethoxycarbonyl-3-(4-fluorophenyl)-N-methyl-6-(2-morpholinoethoxy)inden-1-imine oxide CAS Name: 2-ethoxycarbonyl-3-(4-fluorophenyl)-N-methyl-6-[2-(4-morpholinyl)ethoxy]-1-indenimine oxide IUPAC Name: 2-ethoxycarbonyl-3-(4-fluorophenyl)-N-methyl-6-(2-morpholin-4-ylethoxy)inden-1-imine oxide Traditional Name: 2-carbethoxy-3-(4-fluorophenyl)-N-methyl-6-(2-morpholinoethoxy)inden-1-imine oxide Formula: C25H27FN2O5 MolecularWeight: 454.490683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C1=[N+](C)[O-])C=C(C=C2)OCCN3CCOCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C\1=C(C2=C(/C1=[N+](/C)\[O-])C=C(C=C2)OCCN3CCOCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H27FN2O5/c1-3-32-25(29)23-22(17-4-6-18(26)7-5-17)20-9-8-19(16-21(20)24(23)27(2)30)33-15-12-28-10-13-31-14-11-28/h4-9,16H,3,10-15H2,1-2H3/b27-24+