9-(dicyanomethylidene)-2,2-bis(1-oxidanylbutan-2-yl)-1H-fluorene-4-carboxylate

Systemtic Name: 9-(dicyanomethylidene)-2,2-bis(1-oxidanylbutan-2-yl)-1H-fluorene-4-carboxylate Openeye Name: 9-(dicyanomethylene)-2,2-bis[1-(hydroxymethyl)propyl]-1H-fluorene-4-carboxylate CAS Name: 9-(dicyanomethylidene)-2,2-bis(1-hydroxybutan-2-yl)-1H-fluorene-4-carboxylate IUPAC Name: 9-(dicyanomethylidene)-2,2-bis(1-hydroxybutan-2-yl)-1H-fluorene-4-carboxylate Traditional Name: 9-(dicyanomethylene)-2,2-bis(1-methylolpropyl)-1H-fluorene-4-carboxylate Formula: C25H25N2O4- MolecularWeight: 417.477

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)C1(CC2=C(C3=CC=CC=C3C2=C(C#N)C#N)C(=C1)C(=O)[O-])C(CC)CO

Isomeric SMILES

CCC(CO)C1(CC2=C(C3=CC=CC=C3C2=C(C#N)C#N)C(=C1)C(=O)[O-])C(CC)CO

InChI

InChI=1S/C25H26N2O4/c1-3-16(13-28)25(17(4-2)14-29)9-20-22(15(11-26)12-27)18-7-5-6-8-19(18)23(20)21(10-25)24(30)31/h5-8,10,16-17,28-29H,3-4,9,13-14H2,1-2H3,(H,30,31)/p-1