3-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1H-quinoxalin-2-one Openeye Name: 3-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-3-oxo-propyl]-1H-quinoxalin-2-one CAS Name: 3-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-1-piperazinyl]-3-oxopropyl]-1H-quinoxalin-2-one IUPAC Name: 3-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]-3-oxopropyl]-1H-quinoxalin-2-one Traditional Name: 3-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazino]-3-keto-propyl]-1H-quinoxalin-2-one Formula: C24H26N4O6S MolecularWeight: 498.55144

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCC4=NC5=CC=CC=C5NC4=O)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCC4=NC5=CC=CC=C5NC4=O)OC1

InChI

InChI=1S/C24H26N4O6S/c29-23(9-7-20-24(30)26-19-5-2-1-4-18(19)25-20)27-10-12-28(13-11-27)35(31,32)17-6-8-21-22(16-17)34-15-3-14-33-21/h1-2,4-6,8,16H,3,7,9-15H2,(H,26,30)