3-phenyl-4-[4-[[3-(phenylcarbamoylamino)phenyl]methoxy]phenyl]sulfonyl-butanoic acid

Systemtic Name: 3-phenyl-4-[4-[[3-(phenylcarbamoylamino)phenyl]methoxy]phenyl]sulfonyl-butanoic acid Openeye Name: 3-phenyl-4-[4-[[3-(phenylcarbamoylamino)phenyl]methoxy]phenyl]sulfonyl-butanoic acid CAS Name: 4-[4-[[3-[[anilino(oxo)methyl]amino]phenyl]methoxy]phenyl]sulfonyl-3-phenylbutanoic acid IUPAC Name: 3-phenyl-4-[4-[[3-(phenylcarbamoylamino)phenyl]methoxy]phenyl]sulfonylbutanoic acid Traditional Name: 3-phenyl-4-[4-[3-(phenylcarbamoylamino)benzyl]oxyphenyl]sulfonyl-butyric acid Formula: C30H28N2O6S MolecularWeight: 544.61812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)CS(=O)(=O)C2=CC=C(C=C2)OCC3=CC(=CC=C3)NC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)CS(=O)(=O)C2=CC=C(C=C2)OCC3=CC(=CC=C3)NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C30H28N2O6S/c33-29(34)19-24(23-9-3-1-4-10-23)21-39(36,37)28-16-14-27(15-17-28)38-20-22-8-7-13-26(18-22)32-30(35)31-25-11-5-2-6-12-25/h1-18,24H,19-21H2,(H,33,34)(H2,31,32,35)