2,4-dimethyl-3-(3-methyl-1,4-dioxaspiro[4.5]decan-3-yl)benzenesulfonic acid

Systemtic Name: 2,4-dimethyl-3-(3-methyl-1,4-dioxaspiro[4.5]decan-3-yl)benzenesulfonic acid Openeye Name: 2,4-dimethyl-3-(3-methyl-1,4-dioxaspiro[4.5]decan-3-yl)benzenesulfonic acid CAS Name: 2,4-dimethyl-3-(3-methyl-1,4-dioxaspiro[4.5]decan-3-yl)benzenesulfonic acid IUPAC Name: 2,4-dimethyl-3-(3-methyl-1,4-dioxaspiro[4.5]decan-3-yl)benzenesulfonic acid Traditional Name: 2,4-dimethyl-3-(3-methyl-1,4-dioxaspiro[4.5]decan-3-yl)besylic acid Formula: C17H24O5S MolecularWeight: 340.43446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)O)C)C2(COC3(O2)CCCCC3)C

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)O)C)C2(COC3(O2)CCCCC3)C

InChI

InChI=1S/C17H24O5S/c1-12-7-8-14(23(18,19)20)13(2)15(12)16(3)11-21-17(22-16)9-5-4-6-10-17/h7-8H,4-6,9-11H2,1-3H3,(H,18,19,20)