3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1-phenethyl-quinoxalin-2-one

Systemtic Name: 3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1-phenethyl-quinoxalin-2-one Openeye Name: 3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-propyl]-1-phenethyl-quinoxalin-2-one CAS Name: 3-[3-[4-(4-fluorophenyl)-1-piperazinyl]-3-oxopropyl]-1-phenethyl-2-quinoxalinone IUPAC Name: 3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-1-phenethylquinoxalin-2-one Traditional Name: 3-[3-[4-(4-fluorophenyl)piperazino]-3-keto-propyl]-1-phenethyl-quinoxalin-2-one Formula: C29H29FN4O2 MolecularWeight: 484.564563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCC3=NC4=CC=CC=C4N(C3=O)CCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCC3=NC4=CC=CC=C4N(C3=O)CCC5=CC=CC=C5

InChI

InChI=1S/C29H29FN4O2/c30-23-10-12-24(13-11-23)32-18-20-33(21-19-32)28(35)15-14-26-29(36)34(17-16-22-6-2-1-3-7-22)27-9-5-4-8-25(27)31-26/h1-13H,14-21H2