3-[4-(cyclopentylmethoxy)-3-[1-(2-hydroxyethyl)indol-5-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-(cyclopentylmethoxy)-3-[1-(2-hydroxyethyl)indol-5-yl]phenyl]propanoic acid Openeye Name: 3-[4-(cyclopentylmethoxy)-3-[1-(2-hydroxyethyl)indol-5-yl]phenyl]propanoic acid CAS Name: 3-[4-(cyclopentylmethoxy)-3-[1-(2-hydroxyethyl)-5-indolyl]phenyl]propanoic acid IUPAC Name: 3-[4-(cyclopentylmethoxy)-3-[1-(2-hydroxyethyl)indol-5-yl]phenyl]propanoic acid Traditional Name: 3-[4-(cyclopentylmethoxy)-3-[1-(2-hydroxyethyl)indol-5-yl]phenyl]propionic acid Formula: C25H29NO4 MolecularWeight: 407.50206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)COC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)N(C=C4)CCO

Isomeric SMILES

C1CCC(C1)COC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)N(C=C4)CCO

InChI

InChI=1S/C25H29NO4/c27-14-13-26-12-11-21-16-20(7-8-23(21)26)22-15-18(6-10-25(28)29)5-9-24(22)30-17-19-3-1-2-4-19/h5,7-9,11-12,15-16,19,27H,1-4,6,10,13-14,17H2,(H,28,29)