6-[2-[4-(1,2-dihydroacenaphthylen-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[4-(1,2-dihydroacenaphthylen-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-[4-(1,2-dihydroacenaphthylen-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[4-(1,2-dihydroacenaphthylen-5-yl)-1-piperazinyl]ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-[4-(1,2-dihydroacenaphthylen-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(4-acenaphthen-5-ylpiperazino)ethyl]-4H-1,4-benzoxazin-3-one Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)N4CCN(CC4)CCC5=CC6=C(C=C5)OCC(=O)N6

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)N4CCN(CC4)CCC5=CC6=C(C=C5)OCC(=O)N6

InChI

InChI=1S/C26H27N3O2/c30-25-17-31-24-9-4-18(16-22(24)27-25)10-11-28-12-14-29(15-13-28)23-8-7-20-6-5-19-2-1-3-21(23)26(19)20/h1-4,7-9,16H,5-6,10-15,17H2,(H,27,30)