3-[4-[(4-cyclohexylphenyl)sulfonylamino]-1-oxidanyl-naphthalen-2-yl]sulfanylpropanoic acid

Systemtic Name: 3-[4-[(4-cyclohexylphenyl)sulfonylamino]-1-oxidanyl-naphthalen-2-yl]sulfanylpropanoic acid Openeye Name: 3-[[4-[(4-cyclohexylphenyl)sulfonylamino]-1-hydroxy-2-naphthyl]sulfanyl]propanoic acid CAS Name: 3-[[4-[(4-cyclohexylphenyl)sulfonylamino]-1-hydroxy-2-naphthalenyl]thio]propanoic acid IUPAC Name: 3-[4-[(4-cyclohexylphenyl)sulfonylamino]-1-hydroxynaphthalen-2-yl]sulfanylpropanoic acid Traditional Name: 3-[[4-[(4-cyclohexylphenyl)sulfonylamino]-1-hydroxy-2-naphthyl]thio]propionic acid Formula: C25H27NO5S2 MolecularWeight: 485.61558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C4=CC=CC=C43)O)SCCC(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C4=CC=CC=C43)O)SCCC(=O)O

InChI

InChI=1S/C25H27NO5S2/c27-24(28)14-15-32-23-16-22(20-8-4-5-9-21(20)25(23)29)26-33(30,31)19-12-10-18(11-13-19)17-6-2-1-3-7-17/h4-5,8-13,16-17,26,29H,1-3,6-7,14-15H2,(H,27,28)