3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl-[2-(4-methylpiperazin-1-yl)phenyl]azanide

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl-[2-(4-methylpiperazin-1-yl)phenyl]azanide Openeye Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl-[2-(4-methylpiperazin-1-yl)phenyl]azanide CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl-[2-(4-methyl-1-piperazinyl)phenyl]azanide IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl-[2-(4-methylpiperazin-1-yl)phenyl]azanide Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl-[2-(4-methylpiperazino)phenyl]azanide Formula: C20H24N3O4S- MolecularWeight: 402.48726

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2[N-]S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2[N-]S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H24N3O4S/c1-22-9-11-23(12-10-22)18-6-3-2-5-17(18)21-28(24,25)16-7-8-19-20(15-16)27-14-4-13-26-19/h2-3,5-8,15H,4,9-14H2,1H3/q-1