6-propan-2-yl-3-[4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butyl]azulene-1-carboxylic acid

Systemtic Name: 6-propan-2-yl-3-[4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butyl]azulene-1-carboxylic acid Openeye Name: 6-isopropyl-3-[4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butyl]azulene-1-carboxylic acid CAS Name: 6-propan-2-yl-3-[4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butyl]-1-azulenecarboxylic acid IUPAC Name: 6-propan-2-yl-3-[4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butyl]azulene-1-carboxylic acid Traditional Name: 6-isopropyl-3-[4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butyl]azulene-1-carboxylic acid Formula: C25H26F3NO4S MolecularWeight: 493.53845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C2C(=C(C=C2CCCCNS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(=O)O)C=C1

Isomeric SMILES

CC(C)C1=CC=C2C(=C(C=C2CCCCNS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(=O)O)C=C1

InChI

InChI=1S/C25H26F3NO4S/c1-16(2)17-9-11-21-18(14-23(24(30)31)22(21)12-10-17)6-3-4-13-29-34(32,33)20-8-5-7-19(15-20)25(26,27)28/h5,7-12,14-16,29H,3-4,6,13H2,1-2H3,(H,30,31)