3-[4-[1-(4-fluorophenyl)-1-oxidanylidene-butan-2-yl]piperazin-1-yl]-1,2-dihydroindazol-6-one

Systemtic Name: 3-[4-[1-(4-fluorophenyl)-1-oxidanylidene-butan-2-yl]piperazin-1-yl]-1,2-dihydroindazol-6-one Openeye Name: 3-[4-[1-(4-fluorobenzoyl)propyl]piperazin-1-yl]-1,2-dihydroindazol-6-one CAS Name: 3-[4-[1-(4-fluorophenyl)-1-oxobutan-2-yl]-1-piperazinyl]-1,2-dihydroindazol-6-one IUPAC Name: 3-[4-[1-(4-fluorophenyl)-1-oxobutan-2-yl]piperazin-1-yl]-1,2-dihydroindazol-6-one Traditional Name: 3-[4-[1-(4-fluorobenzoyl)propyl]piperazino]-1,2-dihydroindazol-6-one Formula: C21H23FN4O2 MolecularWeight: 382.431323

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=C(C=C1)F)N2CCN(CC2)C3=C4C=CC(=O)C=C4NN3

Isomeric SMILES

CCC(C(=O)C1=CC=C(C=C1)F)N2CCN(CC2)C3=C4C=CC(=O)C=C4NN3

InChI

InChI=1S/C21H23FN4O2/c1-2-19(20(28)14-3-5-15(22)6-4-14)25-9-11-26(12-10-25)21-17-8-7-16(27)13-18(17)23-24-21/h3-8,13,19,23-24H,2,9-12H2,1H3