3-[3-(phenylsulfonylamino)propyl]azulene-1-carboxylic acid

Systemtic Name: 3-[3-(phenylsulfonylamino)propyl]azulene-1-carboxylic acid Openeye Name: 3-[3-(benzenesulfonamido)propyl]azulene-1-carboxylic acid CAS Name: 3-[3-(benzenesulfonamido)propyl]-1-azulenecarboxylic acid IUPAC Name: 3-[3-(benzenesulfonamido)propyl]azulene-1-carboxylic acid Traditional Name: 3-[3-(benzenesulfonamido)propyl]azulene-1-carboxylic acid Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCCC2=C3C=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCCC2=C3C=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C20H19NO4S/c22-20(23)19-14-15(17-11-5-2-6-12-18(17)19)8-7-13-21-26(24,25)16-9-3-1-4-10-16/h1-6,9-12,14,21H,7-8,13H2,(H,22,23)