2-butoxy-5-(2-methylheptan-2-yl)benzenesulfinic acid

Systemtic Name: 2-butoxy-5-(2-methylheptan-2-yl)benzenesulfinic acid Openeye Name: 2-butoxy-5-(1,1-dimethylhexyl)benzenesulfinic acid CAS Name: 2-butoxy-5-(2-methylheptan-2-yl)benzenesulfinic acid IUPAC Name: 2-butoxy-5-(2-methylheptan-2-yl)benzenesulfinic acid Traditional Name: 2-butoxy-5-(1,1-dimethylhexyl)benzenesulfinic acid Formula: C18H30O3S MolecularWeight: 326.494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=CC(=C(C=C1)OCCCC)S(=O)O

Isomeric SMILES

CCCCCC(C)(C)C1=CC(=C(C=C1)OCCCC)S(=O)O

InChI

InChI=1S/C18H30O3S/c1-5-7-9-12-18(3,4)15-10-11-16(21-13-8-6-2)17(14-15)22(19)20/h10-11,14H,5-9,12-13H2,1-4H3,(H,19,20)