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4-[3-[4-(1-pentylindol-3-yl)piperidin-1-yl]propoxy]benzoic acid

4-[3-[4-(1-pentylindol-3-yl)piperidin-1-yl]propoxy]benzoic acid

Systemtic Name:4-[3-[4-(1-pentylindol-3-yl)piperidin-1-yl]propoxy]benzoic acid
Openeye Name:4-[3-[4-(1-pentylindol-3-yl)-1-piperidyl]propoxy]benzoic acid
CAS Name:4-[3-[4-(1-pentyl-3-indolyl)-1-piperidinyl]propoxy]benzoic acid
IUPAC Name:4-[3-[4-(1-pentylindol-3-yl)piperidin-1-yl]propoxy]benzoic acid
Traditional Name:4-[3-[4-(1-amylindol-3-yl)piperidino]propoxy]benzoic acid
Formula: C28H36N2O3
MolecularWeight: 448.59704
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)CCCOC4=CC=C(C=C4)C(=O)O


Isomeric SMILES

CCCCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)CCCOC4=CC=C(C=C4)C(=O)O


InChI

InChI=1S/C28H36N2O3/c1-2-3-6-17-30-21-26(25-8-4-5-9-27(25)30)22-14-18-29(19-15-22)16-7-20-33-24-12-10-23(11-13-24)28(31)32/h4-5,8-13,21-22H,2-3,6-7,14-20H2,1H3,(H,31,32)


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