3-[4-(cyclohexylmethoxy)-3-(1-methylindol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-(cyclohexylmethoxy)-3-(1-methylindol-5-yl)phenyl]propanoic acid Openeye Name: 3-[4-(cyclohexylmethoxy)-3-(1-methylindol-5-yl)phenyl]propanoic acid CAS Name: 3-[4-(cyclohexylmethoxy)-3-(1-methyl-5-indolyl)phenyl]propanoic acid IUPAC Name: 3-[4-(cyclohexylmethoxy)-3-(1-methylindol-5-yl)phenyl]propanoic acid Traditional Name: 3-[4-(cyclohexylmethoxy)-3-(1-methylindol-5-yl)phenyl]propionic acid Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)C3=C(C=CC(=C3)CCC(=O)O)OCC4CCCCC4

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)C3=C(C=CC(=C3)CCC(=O)O)OCC4CCCCC4

InChI

InChI=1S/C25H29NO3/c1-26-14-13-21-16-20(9-10-23(21)26)22-15-18(8-12-25(27)28)7-11-24(22)29-17-19-5-3-2-4-6-19/h7,9-11,13-16,19H,2-6,8,12,17H2,1H3,(H,27,28)