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5-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)sulfonyl-pentanoic acid

5-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)sulfonyl-pentanoic acid

Systemtic Name:5-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)sulfonyl-pentanoic acid
Openeye Name:5-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)sulfonyl-pentanoic acid
CAS Name:5-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)sulfonylpentanoic acid
IUPAC Name:5-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)sulfonylpentanoic acid
Traditional Name:5-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)sulfonyl-valeric acid
Formula: C23H30O7S
MolecularWeight: 450.5451
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CCC(CC(=O)O)S(=O)(=O)C2=CC(=C(C=C2)OC)OC


Isomeric SMILES

CCCCOC1=CC=C(C=C1)CCC(CC(=O)O)S(=O)(=O)C2=CC(=C(C=C2)OC)OC


InChI

InChI=1S/C23H30O7S/c1-4-5-14-30-18-9-6-17(7-10-18)8-11-20(16-23(24)25)31(26,27)19-12-13-21(28-2)22(15-19)29-3/h6-7,9-10,12-13,15,20H,4-5,8,11,14,16H2,1-3H3,(H,24,25)


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