[4-butyl-9,10-bis(oxidanylidene)anthracen-2-yl]sulfonyl-methyl-sulfamic acid

Systemtic Name: [4-butyl-9,10-bis(oxidanylidene)anthracen-2-yl]sulfonyl-methyl-sulfamic acid Openeye Name: (4-butyl-9,10-dioxo-2-anthryl)sulfonyl-methyl-sulfamic acid CAS Name: (4-butyl-9,10-dioxo-2-anthracenyl)sulfonyl-methylsulfamic acid IUPAC Name: (4-butyl-9,10-dioxoanthracen-2-yl)sulfonyl-methylsulfamic acid Traditional Name: (4-butyl-9,10-diketo-2-anthryl)sulfonyl-methyl-sulfamic acid Formula: C19H19NO7S2 MolecularWeight: 437.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=CC(=C1)S(=O)(=O)N(C)S(=O)(=O)O)C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCC1=C2C(=CC(=C1)S(=O)(=O)N(C)S(=O)(=O)O)C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H19NO7S2/c1-3-4-7-12-10-13(28(23,24)20(2)29(25,26)27)11-16-17(12)19(22)15-9-6-5-8-14(15)18(16)21/h5-6,8-11H,3-4,7H2,1-2H3,(H,25,26,27)