2-[4-(4-fluorophenyl)piperazin-1-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinoline-3-carbonitrile

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinoline-3-carbonitrile Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile CAS Name: 2-[4-(4-fluorophenyl)-1-piperazinyl]-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile Traditional Name: 2-[4-(4-fluorophenyl)piperazino]-5-keto-7,7-dimethyl-6,8-dihydroquinoline-3-carbonitrile Formula: C22H23FN4O MolecularWeight: 378.442623

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=C(C(=N2)N3CCN(CC3)C4=CC=C(C=C4)F)C#N)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=C(C(=N2)N3CCN(CC3)C4=CC=C(C=C4)F)C#N)C(=O)C1)C

InChI

InChI=1S/C22H23FN4O/c1-22(2)12-19-18(20(28)13-22)11-15(14-24)21(25-19)27-9-7-26(8-10-27)17-5-3-16(23)4-6-17/h3-6,11H,7-10,12-13H2,1-2H3