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2-[3-(4-ethylphenyl)butyl]benzenesulfonic acid

2-[3-(4-ethylphenyl)butyl]benzenesulfonic acid

Systemtic Name:2-[3-(4-ethylphenyl)butyl]benzenesulfonic acid
Openeye Name:2-[3-(4-ethylphenyl)butyl]benzenesulfonic acid
CAS Name:2-[3-(4-ethylphenyl)butyl]benzenesulfonic acid
IUPAC Name:2-[3-(4-ethylphenyl)butyl]benzenesulfonic acid
Traditional Name:2-[3-(4-ethylphenyl)butyl]besylic acid
Formula: C18H22O3S
MolecularWeight: 318.43048
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)CCC2=CC=CC=C2S(=O)(=O)O


Isomeric SMILES

CCC1=CC=C(C=C1)C(C)CCC2=CC=CC=C2S(=O)(=O)O


InChI

InChI=1S/C18H22O3S/c1-3-15-9-12-16(13-10-15)14(2)8-11-17-6-4-5-7-18(17)22(19,20)21/h4-7,9-10,12-14H,3,8,11H2,1-2H3,(H,19,20,21)


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