4-[4-(quinolin-2-ylmethoxy)phenyl]sulfonylbenzoic acid

Systemtic Name: 4-[4-(quinolin-2-ylmethoxy)phenyl]sulfonylbenzoic acid Openeye Name: 4-[4-(2-quinolylmethoxy)phenyl]sulfonylbenzoic acid CAS Name: 4-[4-(2-quinolinylmethoxy)phenyl]sulfonylbenzoic acid IUPAC Name: 4-[4-(quinolin-2-ylmethoxy)phenyl]sulfonylbenzoic acid Traditional Name: 4-[4-(2-quinolylmethoxy)phenyl]sulfonylbenzoic acid Formula: C23H17NO5S MolecularWeight: 419.44978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H17NO5S/c25-23(26)17-6-11-20(12-7-17)30(27,28)21-13-9-19(10-14-21)29-15-18-8-5-16-3-1-2-4-22(16)24-18/h1-14H,15H2,(H,25,26)