4-[3-[4-[1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]propoxy]benzoic acid

Systemtic Name: 4-[3-[4-[1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]propoxy]benzoic acid Openeye Name: 4-[3-[4-[1-(2-ethoxyethyl)indol-3-yl]-1-piperidyl]propoxy]benzoic acid CAS Name: 4-[3-[4-[1-(2-ethoxyethyl)-3-indolyl]-1-piperidinyl]propoxy]benzoic acid IUPAC Name: 4-[3-[4-[1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]propoxy]benzoic acid Traditional Name: 4-[3-[4-[1-(2-ethoxyethyl)indol-3-yl]piperidino]propoxy]benzoic acid Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)CCCOC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCOCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)CCCOC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C27H34N2O4/c1-2-32-19-17-29-20-25(24-6-3-4-7-26(24)29)21-12-15-28(16-13-21)14-5-18-33-23-10-8-22(9-11-23)27(30)31/h3-4,6-11,20-21H,2,5,12-19H2,1H3,(H,30,31)