3-bromanyl-2-[4-(4-fluorophenyl)piperazin-1-yl]-7,7-dimethyl-6,8-dihydroquinolin-5-one

Systemtic Name: 3-bromanyl-2-[4-(4-fluorophenyl)piperazin-1-yl]-7,7-dimethyl-6,8-dihydroquinolin-5-one Openeye Name: 3-bromo-2-[4-(4-fluorophenyl)piperazin-1-yl]-7,7-dimethyl-6,8-dihydroquinolin-5-one CAS Name: 3-bromo-2-[4-(4-fluorophenyl)-1-piperazinyl]-7,7-dimethyl-6,8-dihydroquinolin-5-one IUPAC Name: 3-bromo-2-[4-(4-fluorophenyl)piperazin-1-yl]-7,7-dimethyl-6,8-dihydroquinolin-5-one Traditional Name: 3-bromo-2-[4-(4-fluorophenyl)piperazino]-7,7-dimethyl-6,8-dihydroquinolin-5-one Formula: C21H23BrFN3O MolecularWeight: 432.329223

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=NC(=C(C=C2C(=O)C1)Br)N3CCN(CC3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1(CC2=NC(=C(C=C2C(=O)C1)Br)N3CCN(CC3)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C21H23BrFN3O/c1-21(2)12-18-16(19(27)13-21)11-17(22)20(24-18)26-9-7-25(8-10-26)15-5-3-14(23)4-6-15/h3-6,11H,7-10,12-13H2,1-2H3