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2H-benzo[f]isoindole; 3-ethoxycarbonyl-3-oxidanyl-pentanedioate

2H-benzo[f]isoindole; 3-ethoxycarbonyl-3-oxidanyl-pentanedioate

Systemtic Name:2H-benzo[f]isoindole; 3-ethoxycarbonyl-3-oxidanyl-pentanedioate
Openeye Name:2H-benzo[f]isoindole; 3-ethoxycarbonyl-3-hydroxy-pentanedioate
CAS Name:2H-benzo[f]isoindole; 3-ethoxycarbonyl-3-hydroxypentanedioate
IUPAC Name:2H-benzo[f]isoindole; 3-ethoxycarbonyl-3-hydroxypentanedioate
Traditional Name:2H-benz[f]isoindole; 3-carbethoxy-3-hydroxy-glutarate
Formula: C20H19NO7-2
MolecularWeight: 385.36736
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)[O-])(CC(=O)[O-])O.C1=CC2=CC3=CNC=C3C=C2C=C1


Isomeric SMILES

CCOC(=O)C(CC(=O)[O-])(CC(=O)[O-])O.C1=CC2=CC3=CNC=C3C=C2C=C1


InChI

InChI=1S/C12H9N.C8H12O7/c1-2-4-10-6-12-8-13-7-11(12)5-9(10)3-1;1-2-15-7(13)8(14,3-5(9)10)4-6(11)12/h1-8,13H;14H,2-4H2,1H3,(H,9,10)(H,11,12)/p-2


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