4-[4-[4-(methylsulfonylamino)phenoxy]-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]butanoic acid

Systemtic Name: 4-[4-[4-(methylsulfonylamino)phenoxy]-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]butanoic acid Openeye Name: 4-[4-[4-(methanesulfonamido)phenoxy]-2-[1-(1-naphthyl)ethylcarbamoyl]phenyl]butanoic acid CAS Name: 4-[4-[4-(methanesulfonamido)phenoxy]-2-[[1-(1-naphthalenyl)ethylamino]-oxomethyl]phenyl]butanoic acid IUPAC Name: 4-[4-[4-(methanesulfonamido)phenoxy]-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]butanoic acid Traditional Name: 4-[4-[4-(methanesulfonamido)phenoxy]-2-[1-(1-naphthyl)ethylcarbamoyl]phenyl]butyric acid Formula: C30H30N2O6S MolecularWeight: 546.634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=C(C=CC(=C3)OC4=CC=C(C=C4)NS(=O)(=O)C)CCCC(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=C(C=CC(=C3)OC4=CC=C(C=C4)NS(=O)(=O)C)CCCC(=O)O

InChI

InChI=1S/C30H30N2O6S/c1-20(26-11-5-8-21-7-3-4-10-27(21)26)31-30(35)28-19-25(16-13-22(28)9-6-12-29(33)34)38-24-17-14-23(15-18-24)32-39(2,36)37/h3-5,7-8,10-11,13-20,32H,6,9,12H2,1-2H3,(H,31,35)(H,33,34)