10-methylundecyl 1-(3,5-dimethylphenyl)ethanesulfonate

Systemtic Name: 10-methylundecyl 1-(3,5-dimethylphenyl)ethanesulfonate Openeye Name: 10-methylundecyl 1-(3,5-dimethylphenyl)ethanesulfonate CAS Name: 1-(3,5-dimethylphenyl)ethanesulfonic acid 10-methylundecyl ester IUPAC Name: 10-methylundecyl 1-(3,5-dimethylphenyl)ethanesulfonate Traditional Name: 1-(3,5-dimethylphenyl)ethanesulfonic acid 10-methylundecyl ester Formula: C22H38O3S MolecularWeight: 382.60032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C)S(=O)(=O)OCCCCCCCCCC(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C)S(=O)(=O)OCCCCCCCCCC(C)C)C

InChI

InChI=1S/C22H38O3S/c1-18(2)13-11-9-7-6-8-10-12-14-25-26(23,24)21(5)22-16-19(3)15-20(4)17-22/h15-18,21H,6-14H2,1-5H3