3-[4-[4-(2,3-dihydro-1-benzofuran-5-yl)piperidin-1-yl]butyl]-1H-indole-5-carboxylic acid

Systemtic Name: 3-[4-[4-(2,3-dihydro-1-benzofuran-5-yl)piperidin-1-yl]butyl]-1H-indole-5-carboxylic acid Openeye Name: 3-[4-[4-(2,3-dihydrobenzofuran-5-yl)-1-piperidyl]butyl]-1H-indole-5-carboxylic acid CAS Name: 3-[4-[4-(2,3-dihydrobenzofuran-5-yl)-1-piperidinyl]butyl]-1H-indole-5-carboxylic acid IUPAC Name: 3-[4-[4-(2,3-dihydro-1-benzofuran-5-yl)piperidin-1-yl]butyl]-1H-indole-5-carboxylic acid Traditional Name: 3-[4-(4-coumaran-5-ylpiperidino)butyl]-1H-indole-5-carboxylic acid Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC3=C(C=C2)OCC3)CCCCC4=CNC5=C4C=C(C=C5)C(=O)O

Isomeric SMILES

C1CN(CCC1C2=CC3=C(C=C2)OCC3)CCCCC4=CNC5=C4C=C(C=C5)C(=O)O

InChI

InChI=1S/C26H30N2O3/c29-26(30)21-4-6-24-23(16-21)22(17-27-24)3-1-2-11-28-12-8-18(9-13-28)19-5-7-25-20(15-19)10-14-31-25/h4-7,15-18,27H,1-3,8-14H2,(H,29,30)