2-[4-(cyclohexylmethoxy)-3-(2,3-dimethyl-1H-indol-5-yl)phenyl]propanoic acid

Systemtic Name: 2-[4-(cyclohexylmethoxy)-3-(2,3-dimethyl-1H-indol-5-yl)phenyl]propanoic acid Openeye Name: 2-[4-(cyclohexylmethoxy)-3-(2,3-dimethyl-1H-indol-5-yl)phenyl]propanoic acid CAS Name: 2-[4-(cyclohexylmethoxy)-3-(2,3-dimethyl-1H-indol-5-yl)phenyl]propanoic acid IUPAC Name: 2-[4-(cyclohexylmethoxy)-3-(2,3-dimethyl-1H-indol-5-yl)phenyl]propanoic acid Traditional Name: 2-[4-(cyclohexylmethoxy)-3-(2,3-dimethyl-1H-indol-5-yl)phenyl]propionic acid Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C3=C(C=CC(=C3)C(C)C(=O)O)OCC4CCCCC4)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C3=C(C=CC(=C3)C(C)C(=O)O)OCC4CCCCC4)C

InChI

InChI=1S/C26H31NO3/c1-16-18(3)27-24-11-9-21(14-22(16)24)23-13-20(17(2)26(28)29)10-12-25(23)30-15-19-7-5-4-6-8-19/h9-14,17,19,27H,4-8,15H2,1-3H3,(H,28,29)