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

Systemtic Name: 4-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonyl-methyl-amino]-N-ethyl-butanamide Openeye Name: 4-[(9,10-dioxo-2-anthryl)sulfonyl-methyl-amino]-N-ethyl-butanamide CAS Name: 4-[(9,10-dioxo-2-anthracenyl)sulfonyl-methylamino]-N-ethylbutanamide IUPAC Name: 4-[(9,10-dioxoanthracen-2-yl)sulfonyl-methylamino]-N-ethylbutanamide Traditional Name: 4-[(9,10-diketo-2-anthryl)sulfonyl-methyl-amino]-N-ethyl-butyramide Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O5S/c1-3-22-19(24)9-6-12-23(2)29(27,28)14-10-11-17-18(13-14)21(26)16-8-5-4-7-15(16)20(17)25/h4-5,7-8,10-11,13H,3,6,9,12H2,1-2H3,(H,22,24)