2-(4-methylsulfonylphenyl)-3-phenyl-azulene-1-carboxylic acid

Systemtic Name: 2-(4-methylsulfonylphenyl)-3-phenyl-azulene-1-carboxylic acid Openeye Name: 2-(4-methylsulfonylphenyl)-3-phenyl-azulene-1-carboxylic acid CAS Name: 2-(4-methylsulfonylphenyl)-3-phenyl-1-azulenecarboxylic acid IUPAC Name: 2-(4-methylsulfonylphenyl)-3-phenylazulene-1-carboxylic acid Traditional Name: 2-(4-mesylphenyl)-3-phenyl-azulene-1-carboxylic acid Formula: C24H18O4S MolecularWeight: 402.46232

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C3=CC=CC=CC3=C2C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C3=CC=CC=CC3=C2C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C24H18O4S/c1-29(27,28)18-14-12-17(13-15-18)22-21(16-8-4-2-5-9-16)19-10-6-3-7-11-20(19)23(22)24(25)26/h2-15H,1H3,(H,25,26)