1,2-dihydroacenaphthylen-5-yl-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: 1,2-dihydroacenaphthylen-5-yl-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]methanone Openeye Name: 1,2-dihydroacenaphthylen-5-yl-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]methanone CAS Name: 1,2-dihydroacenaphthylen-5-yl-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-1-piperazinyl]methanone IUPAC Name: 1,2-dihydroacenaphthylen-5-yl-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazin-1-yl]methanone Traditional Name: acenaphthen-5-yl-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazino]methanone Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=C5C=CC=C6C5=C(CC6)C=C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=C5C=CC=C6C5=C(CC6)C=C4)OC1

InChI

InChI=1S/C26H26N2O5S/c29-26(22-9-7-19-6-5-18-3-1-4-21(22)25(18)19)27-11-13-28(14-12-27)34(30,31)20-8-10-23-24(17-20)33-16-2-15-32-23/h1,3-4,7-10,17H,2,5-6,11-16H2