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

Systemtic Name: 1,4-bis(oxidanylidene)-1,4-bis(4-phenylbutoxy)butane-2-sulfonic acid Openeye Name: 1,4-dioxo-1,4-bis(4-phenylbutoxy)butane-2-sulfonic acid CAS Name: 1,4-dioxo-1,4-bis(4-phenylbutoxy)-2-butanesulfonic acid IUPAC Name: 1,4-dioxo-1,4-bis(4-phenylbutoxy)butane-2-sulfonic acid Traditional Name: 1,4-diketo-1,4-bis(4-phenylbutoxy)butane-2-sulfonic acid Formula: C24H30O7S MolecularWeight: 462.5558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC(=O)CC(C(=O)OCCCCC2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC(=O)CC(C(=O)OCCCCC2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C24H30O7S/c25-23(30-17-9-7-15-20-11-3-1-4-12-20)19-22(32(27,28)29)24(26)31-18-10-8-16-21-13-5-2-6-14-21/h1-6,11-14,22H,7-10,15-19H2,(H,27,28,29)