N3,N8-bis(2-methyl-1-oxidanyl-propan-2-yl)-6-oxidanylidene-benzo[c]chromene-3,8-disulfonamide

Systemtic Name: N3,N8-bis(2-methyl-1-oxidanyl-propan-2-yl)-6-oxidanylidene-benzo[c]chromene-3,8-disulfonamide Openeye Name: N3,N8-bis(2-hydroxy-1,1-dimethyl-ethyl)-6-oxo-benzo[c]chromene-3,8-disulfonamide CAS Name: N3,N8-bis(1-hydroxy-2-methylpropan-2-yl)-6-oxobenzo[c][1]benzopyran-3,8-disulfonamide IUPAC Name: 3-N,8-N-bis(1-hydroxy-2-methylpropan-2-yl)-6-oxobenzo[c]chromene-3,8-disulfonamide Traditional Name: N,N'-bis(2-hydroxy-1,1-dimethyl-ethyl)-6-keto-benzo[c]chromene-3,8-disulfonamide Formula: C21H26N2O8S2 MolecularWeight: 498.56974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NS(=O)(=O)C1=CC2=C(C=C1)C3=C(C=C(C=C3)S(=O)(=O)NC(C)(C)CO)OC2=O

Isomeric SMILES

CC(C)(CO)NS(=O)(=O)C1=CC2=C(C=C1)C3=C(C=C(C=C3)S(=O)(=O)NC(C)(C)CO)OC2=O

InChI

InChI=1S/C21H26N2O8S2/c1-20(2,11-24)22-32(27,28)13-5-7-15-16-8-6-14(33(29,30)23-21(3,4)12-25)10-18(16)31-19(26)17(15)9-13/h5-10,22-25H,11-12H2,1-4H3