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

Systemtic Name: 3-(4-cyanophenyl)-2-ethoxycarbonyl-N-methyl-6-(2-morpholin-4-ylethoxy)inden-1-imine oxide Openeye Name: 3-(4-cyanophenyl)-2-ethoxycarbonyl-N-methyl-6-(2-morpholinoethoxy)inden-1-imine oxide CAS Name: 3-(4-cyanophenyl)-2-ethoxycarbonyl-N-methyl-6-[2-(4-morpholinyl)ethoxy]-1-indenimine oxide IUPAC Name: 3-(4-cyanophenyl)-2-ethoxycarbonyl-N-methyl-6-(2-morpholin-4-ylethoxy)inden-1-imine oxide Traditional Name: 2-carbethoxy-3-(4-cyanophenyl)-N-methyl-6-(2-morpholinoethoxy)inden-1-imine oxide Formula: C26H27N3O5 MolecularWeight: 461.50968

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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)C#N

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O5/c1-3-33-26(30)24-23(19-6-4-18(17-27)5-7-19)21-9-8-20(16-22(21)25(24)28(2)31)34-15-12-29-10-13-32-14-11-29/h4-9,16H,3,10-15H2,1-2H3/b28-25+