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2-ethoxy-4-(1-pentylindol-3-yl)-3-piperidin-1-yl-benzoic acid

2-ethoxy-4-(1-pentylindol-3-yl)-3-piperidin-1-yl-benzoic acid

Systemtic Name:2-ethoxy-4-(1-pentylindol-3-yl)-3-piperidin-1-yl-benzoic acid
Openeye Name:2-ethoxy-4-(1-pentylindol-3-yl)-3-(1-piperidyl)benzoic acid
CAS Name:2-ethoxy-4-(1-pentyl-3-indolyl)-3-(1-piperidinyl)benzoic acid
IUPAC Name:2-ethoxy-4-(1-pentylindol-3-yl)-3-piperidin-1-ylbenzoic acid
Traditional Name:4-(1-amylindol-3-yl)-2-ethoxy-3-piperidino-benzoic acid
Formula: C27H34N2O3
MolecularWeight: 434.57046
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C2=CC=CC=C21)C3=C(C(=C(C=C3)C(=O)O)OCC)N4CCCCC4


Isomeric SMILES

CCCCCN1C=C(C2=CC=CC=C21)C3=C(C(=C(C=C3)C(=O)O)OCC)N4CCCCC4


InChI

InChI=1S/C27H34N2O3/c1-3-5-9-18-29-19-23(20-12-7-8-13-24(20)29)21-14-15-22(27(30)31)26(32-4-2)25(21)28-16-10-6-11-17-28/h7-8,12-15,19H,3-6,9-11,16-18H2,1-2H3,(H,30,31)


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