4-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonyl-methyl-amino]-N-methyl-butanamide

Systemtic Name: 4-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonyl-methyl-amino]-N-methyl-butanamide Openeye Name: 4-[(9,10-dioxo-2-anthryl)sulfonyl-methyl-amino]-N-methyl-butanamide CAS Name: 4-[(9,10-dioxo-2-anthracenyl)sulfonyl-methylamino]-N-methylbutanamide IUPAC Name: 4-[(9,10-dioxoanthracen-2-yl)sulfonyl-methylamino]-N-methylbutanamide Traditional Name: 4-[(9,10-diketo-2-anthryl)sulfonyl-methyl-amino]-N-methyl-butyramide Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCCN(C)S(=O)(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CNC(=O)CCCN(C)S(=O)(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H20N2O5S/c1-21-18(23)8-5-11-22(2)28(26,27)13-9-10-16-17(12-13)20(25)15-7-4-3-6-14(15)19(16)24/h3-4,6-7,9-10,12H,5,8,11H2,1-2H3,(H,21,23)