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3-[6-(phenylsulfonylamino)hexyl]azulene-1-carboxylic acid

3-[6-(phenylsulfonylamino)hexyl]azulene-1-carboxylic acid

Systemtic Name:3-[6-(phenylsulfonylamino)hexyl]azulene-1-carboxylic acid
Openeye Name:3-[6-(benzenesulfonamido)hexyl]azulene-1-carboxylic acid
CAS Name:3-[6-(benzenesulfonamido)hexyl]-1-azulenecarboxylic acid
IUPAC Name:3-[6-(benzenesulfonamido)hexyl]azulene-1-carboxylic acid
Traditional Name:3-[6-(benzenesulfonamido)hexyl]azulene-1-carboxylic acid
Formula: C23H25NO4S
MolecularWeight: 411.5139
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCCCCCC2=C3C=CC=CC=C3C(=C2)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCCCCCC2=C3C=CC=CC=C3C(=C2)C(=O)O


InChI

InChI=1S/C23H25NO4S/c25-23(26)22-17-18(20-14-8-4-9-15-21(20)22)11-5-1-2-10-16-24-29(27,28)19-12-6-3-7-13-19/h3-4,6-9,12-15,17,24H,1-2,5,10-11,16H2,(H,25,26)


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