2-[4-[4-(dibutylamino)phenyl]sulfanylphenyl]ethanoic acid

Systemtic Name: 2-[4-[4-(dibutylamino)phenyl]sulfanylphenyl]ethanoic acid Openeye Name: 2-[4-[4-(dibutylamino)phenyl]sulfanylphenyl]acetic acid CAS Name: 2-[4-[[4-(dibutylamino)phenyl]thio]phenyl]acetic acid IUPAC Name: 2-[4-[4-(dibutylamino)phenyl]sulfanylphenyl]acetic acid Traditional Name: 2-[4-[[4-(dibutylamino)phenyl]thio]phenyl]acetic acid Formula: C22H29NO2S MolecularWeight: 371.53616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC=C(C=C1)SC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CCCCN(CCCC)C1=CC=C(C=C1)SC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C22H29NO2S/c1-3-5-15-23(16-6-4-2)19-9-13-21(14-10-19)26-20-11-7-18(8-12-20)17-22(24)25/h7-14H,3-6,15-17H2,1-2H3,(H,24,25)