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

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-4-(4-methylphenyl)sulfonyl-butanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-4-(p-tolylsulfonyl)butanamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-4-(4-methylphenyl)sulfonylbutanamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-4-(4-methylphenyl)sulfonylbutanamide Traditional Name: N-(9,10-diketo-2-anthryl)-4-tosyl-butyramide Formula: C25H21NO5S MolecularWeight: 447.50294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H21NO5S/c1-16-8-11-18(12-9-16)32(30,31)14-4-7-23(27)26-17-10-13-21-22(15-17)25(29)20-6-3-2-5-19(20)24(21)28/h2-3,5-6,8-13,15H,4,7,14H2,1H3,(H,26,27)