4-butoxy-1-octoxy-1,4-bis(oxidanylidene)butane-2-sulfonic acid

Systemtic Name: 4-butoxy-1-octoxy-1,4-bis(oxidanylidene)butane-2-sulfonic acid Openeye Name: 4-butoxy-1-octoxy-1,4-dioxo-butane-2-sulfonic acid CAS Name: 4-butoxy-1-octoxy-1,4-dioxo-2-butanesulfonic acid IUPAC Name: 4-butoxy-1-octoxy-1,4-dioxobutane-2-sulfonic acid Traditional Name: 4-butoxy-1,4-diketo-1-octoxy-butane-2-sulfonic acid Formula: C16H30O7S MolecularWeight: 366.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CC(=O)OCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)C(CC(=O)OCCCC)S(=O)(=O)O

InChI

InChI=1S/C16H30O7S/c1-3-5-7-8-9-10-12-23-16(18)14(24(19,20)21)13-15(17)22-11-6-4-2/h14H,3-13H2,1-2H3,(H,19,20,21)