3-[[2-[4-cyclopentyloxy-3-(trifluoromethyl)phenyl]-1-benzothiophen-5-yl]methylamino]propanoic acid

Systemtic Name: 3-[[2-[4-cyclopentyloxy-3-(trifluoromethyl)phenyl]-1-benzothiophen-5-yl]methylamino]propanoic acid Openeye Name: 3-[[2-[4-(cyclopentoxy)-3-(trifluoromethyl)phenyl]benzothiophen-5-yl]methylamino]propanoic acid CAS Name: 3-[[2-[4-cyclopentyloxy-3-(trifluoromethyl)phenyl]-1-benzothiophen-5-yl]methylamino]propanoic acid IUPAC Name: 3-[[2-[4-cyclopentyloxy-3-(trifluoromethyl)phenyl]-1-benzothiophen-5-yl]methylamino]propanoic acid Traditional Name: 3-[[2-[4-(cyclopentoxy)-3-(trifluoromethyl)phenyl]benzothiophen-5-yl]methylamino]propionic acid Formula: C24H24F3NO3S MolecularWeight: 463.51247

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=C(C=C(C=C2)C3=CC4=C(S3)C=CC(=C4)CNCCC(=O)O)C(F)(F)F

Isomeric SMILES

C1CCC(C1)OC2=C(C=C(C=C2)C3=CC4=C(S3)C=CC(=C4)CNCCC(=O)O)C(F)(F)F

InChI

InChI=1S/C24H24F3NO3S/c25-24(26,27)19-12-16(6-7-20(19)31-18-3-1-2-4-18)22-13-17-11-15(5-8-21(17)32-22)14-28-10-9-23(29)30/h5-8,11-13,18,28H,1-4,9-10,14H2,(H,29,30)