[3-cyano-4-(4-fluorophenyl)-2-oxidanylidene-4-piperidin-1-yl-but-3-enyl] 1H-indazole-3-carboxylate

Systemtic Name: [3-cyano-4-(4-fluorophenyl)-2-oxidanylidene-4-piperidin-1-yl-but-3-enyl] 1H-indazole-3-carboxylate Openeye Name: [3-cyano-4-(4-fluorophenyl)-2-oxo-4-(1-piperidyl)but-3-enyl] 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [3-cyano-4-(4-fluorophenyl)-2-oxo-4-(1-piperidinyl)but-3-enyl] ester IUPAC Name: [3-cyano-4-(4-fluorophenyl)-2-oxo-4-piperidin-1-ylbut-3-enyl] 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [3-cyano-4-(4-fluorophenyl)-2-keto-4-piperidino-but-3-enyl] ester Formula: C24H21FN4O3 MolecularWeight: 432.446943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=C(C#N)C(=O)COC(=O)C2=NNC3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)C(=C(C#N)C(=O)COC(=O)C2=NNC3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H21FN4O3/c25-17-10-8-16(9-11-17)23(29-12-4-1-5-13-29)19(14-26)21(30)15-32-24(31)22-18-6-2-3-7-20(18)27-28-22/h2-3,6-11H,1,4-5,12-13,15H2,(H,27,28)