dodecyl hydrogen sulfate; 5-methylquinolin-8-ol

Systemtic Name: dodecyl hydrogen sulfate; 5-methylquinolin-8-ol Openeye Name: dodecyl hydrogen sulfate; 5-methylquinolin-8-ol CAS Name: 5-methyl-8-quinolinol; sulfuric acid dodecyl ester IUPAC Name: dodecyl hydrogen sulfate; 5-methylquinolin-8-ol Traditional Name: 5-methylquinolin-8-ol; sulfuric acid lauryl ester Formula: C22H35NO5S MolecularWeight: 425.582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOS(=O)(=O)O.CC1=C2C=CC=NC2=C(C=C1)O

Isomeric SMILES

CCCCCCCCCCCCOS(=O)(=O)O.CC1=C2C=CC=NC2=C(C=C1)O

InChI

InChI=1S/C12H26O4S.C10H9NO/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;1-7-4-5-9(12)10-8(7)3-2-6-11-10/h2-12H2,1H3,(H,13,14,15);2-6,12H,1H3