N-methyl-N-[4-(4-methylpiperidin-1-yl)-4-oxidanylidene-butyl]-9,10-bis(oxidanylidene)anthracene-2-sulfonamide

Systemtic Name: N-methyl-N-[4-(4-methylpiperidin-1-yl)-4-oxidanylidene-butyl]-9,10-bis(oxidanylidene)anthracene-2-sulfonamide Openeye Name: N-methyl-N-[4-(4-methyl-1-piperidyl)-4-oxo-butyl]-9,10-dioxo-anthracene-2-sulfonamide CAS Name: N-methyl-N-[4-(4-methyl-1-piperidinyl)-4-oxobutyl]-9,10-dioxo-2-anthracenesulfonamide IUPAC Name: N-methyl-N-[4-(4-methylpiperidin-1-yl)-4-oxobutyl]-9,10-dioxoanthracene-2-sulfonamide Traditional Name: 9,10-diketo-N-[4-keto-4-(4-methylpiperidino)butyl]-N-methyl-anthracene-2-sulfonamide Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CCCN(C)S(=O)(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1CCN(CC1)C(=O)CCCN(C)S(=O)(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H28N2O5S/c1-17-11-14-27(15-12-17)23(28)8-5-13-26(2)33(31,32)18-9-10-21-22(16-18)25(30)20-7-4-3-6-19(20)24(21)29/h3-4,6-7,9-10,16-17H,5,8,11-15H2,1-2H3