N2,N6-bis(1-oxidanylbutan-2-yl)-9,10-bis(oxidanylidene)anthracene-2,6-disulfonamide

Systemtic Name: N2,N6-bis(1-oxidanylbutan-2-yl)-9,10-bis(oxidanylidene)anthracene-2,6-disulfonamide Openeye Name: N2,N6-bis[1-(hydroxymethyl)propyl]-9,10-dioxo-anthracene-2,6-disulfonamide CAS Name: N2,N6-bis(1-hydroxybutan-2-yl)-9,10-dioxoanthracene-2,6-disulfonamide IUPAC Name: 2-N,6-N-bis(1-hydroxybutan-2-yl)-9,10-dioxoanthracene-2,6-disulfonamide Traditional Name: 9,10-diketo-N,N'-bis(1-methylolpropyl)anthracene-2,6-disulfonamide Formula: C22H26N2O8S2 MolecularWeight: 510.58044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NS(=O)(=O)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=CC(=C3)S(=O)(=O)NC(CC)CO

Isomeric SMILES

CCC(CO)NS(=O)(=O)C1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=CC(=C3)S(=O)(=O)NC(CC)CO

InChI

InChI=1S/C22H26N2O8S2/c1-3-13(11-25)23-33(29,30)15-5-7-17-19(9-15)21(27)18-8-6-16(10-20(18)22(17)28)34(31,32)24-14(4-2)12-26/h5-10,13-14,23-26H,3-4,11-12H2,1-2H3