2-[2-[4-(4-chlorophenyl)phenyl]sulfonylethyl]naphthalene-1-carboxylic acid

Systemtic Name: 2-[2-[4-(4-chlorophenyl)phenyl]sulfonylethyl]naphthalene-1-carboxylic acid Openeye Name: 2-[2-[4-(4-chlorophenyl)phenyl]sulfonylethyl]naphthalene-1-carboxylic acid CAS Name: 2-[2-[4-(4-chlorophenyl)phenyl]sulfonylethyl]-1-naphthalenecarboxylic acid IUPAC Name: 2-[2-[4-(4-chlorophenyl)phenyl]sulfonylethyl]naphthalene-1-carboxylic acid Traditional Name: 2-[2-[4-(4-chlorophenyl)phenyl]sulfonylethyl]-1-naphthoic acid Formula: C25H19ClO4S MolecularWeight: 450.93396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2C(=O)O)CCS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2C(=O)O)CCS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H19ClO4S/c26-21-11-7-17(8-12-21)18-9-13-22(14-10-18)31(29,30)16-15-20-6-5-19-3-1-2-4-23(19)24(20)25(27)28/h1-14H,15-16H2,(H,27,28)