dipotassium 3-[[(2Z)-2-(3-oxidanidylperoxysulfanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-7-oxidanylidene-4-propan-2-yloxy-3H-benzo[e]perimidin-6-yl]carbamoyloxy]benzenesulfonate

Systemtic Name: dipotassium 3-[[(2Z)-2-(3-oxidanidylperoxysulfanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-7-oxidanylidene-4-propan-2-yloxy-3H-benzo[e]perimidin-6-yl]carbamoyloxy]benzenesulfonate Openeye Name: dipotassium 3-[[(2Z)-4-isopropoxy-2-(3-oxidoperoxysulfanyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-7-oxo-3H-benzo[e]perimidin-6-yl]carbamoyloxy]benzenesulfonate CAS Name: dipotassium 3-[[[(2Z)-2-[3-(oxidodioxythio)-6-oxo-1-cyclohexa-2,4-dienylidene]-7-oxo-4-propan-2-yloxy-3H-benzo[e]perimidin-6-yl]amino]-oxomethoxy]benzenesulfonate IUPAC Name: dipotassium 3-[[(2Z)-2-(3-oxidoperoxysulfanyl-6-oxocyclohexa-2,4-dien-1-ylidene)-7-oxo-4-propan-2-yloxy-3H-benzo[e]perimidin-6-yl]carbamoyloxy]benzenesulfonate Traditional Name: dipotassium 3-[[(2Z)-4-isopropoxy-7-keto-2-[6-keto-3-(oxidoperoxythio)cyclohexa-2,4-dien-1-ylidene]-3H-benzo[e]perimidin-6-yl]carbamoyloxy]besylate Formula: C31H21K2N3O11S2 MolecularWeight: 753.83854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C2C3=C(C(=C1)NC(=O)OC4=CC(=CC=C4)S(=O)(=O)[O-])C(=O)C5=CC=CC=C5C3=NC(=C6C=C(C=CC6=O)SOO[O-])N2.[K+].[K+]

Isomeric SMILES

CC(C)OC1=C2C3=C(C(=C1)NC(=O)OC4=CC(=CC=C4)S(=O)(=O)[O-])C(=O)C5=CC=CC=C5C3=N/C(=C\6/C=C(C=CC6=O)SOO[O-])/N2.[K+].[K+]

InChI

InChI=1S/C31H23N3O11S2.2K/c1-15(2)42-24-14-22(32-31(37)43-16-6-5-7-18(12-16)47(39,40)41)25-26-27(19-8-3-4-9-20(19)29(25)36)33-30(34-28(24)26)21-13-17(46-45-44-38)10-11-23(21)35;;/h3-15,34,38H,1-2H3,(H,32,37)(H,39,40,41);;/q;2*+1/p-2/b30-21+;;