4-heptoxycarbonyloxybenzenesulfonic acid

Systemtic Name: 4-heptoxycarbonyloxybenzenesulfonic acid Openeye Name: 4-heptoxycarbonyloxybenzenesulfonic acid CAS Name: 4-[heptoxy(oxo)methoxy]benzenesulfonic acid IUPAC Name: 4-heptoxycarbonyloxybenzenesulfonic acid Traditional Name: 4-heptoxycarbonyloxybesylic acid Formula: C14H20O6S MolecularWeight: 316.37

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)OC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCCOC(=O)OC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C14H20O6S/c1-2-3-4-5-6-11-19-14(15)20-12-7-9-13(10-8-12)21(16,17)18/h7-10H,2-6,11H2,1H3,(H,16,17,18)