2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-3-(2-phenoxyethylsulfanyl)-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-3-(2-phenoxyethylsulfanyl)-3-phenyl-propanoic acid Openeye Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-3-(2-phenoxyethylsulfanyl)-3-phenyl-propanoic acid CAS Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-3-(2-phenoxyethylthio)-3-phenylpropanoic acid IUPAC Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-3-(2-phenoxyethylsulfanyl)-3-phenylpropanoic acid Traditional Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-3-(2-phenoxyethylthio)-3-phenyl-propionic acid Formula: C30H29NO6S2 MolecularWeight: 563.68436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(C(C3=CC=CC=C3)SCCOC4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(C(C3=CC=CC=C3)SCCOC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C30H29NO6S2/c1-36-25-16-12-22(13-17-25)23-14-18-27(19-15-23)39(34,35)31-28(30(32)33)29(24-8-4-2-5-9-24)38-21-20-37-26-10-6-3-7-11-26/h2-19,28-29,31H,20-21H2,1H3,(H,32,33)