2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoic acid

Systemtic Name: 2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoic acid Openeye Name: 2-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]benzoic acid CAS Name: 2-[2-hydroxy-3-[4-(2-methoxyphenyl)-1-piperazinyl]propoxy]benzoic acid IUPAC Name: 2-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]benzoic acid Traditional Name: 2-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazino]propoxy]benzoic acid Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC=C3C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC=C3C(=O)O)O

InChI

InChI=1S/C21H26N2O5/c1-27-20-9-5-3-7-18(20)23-12-10-22(11-13-23)14-16(24)15-28-19-8-4-2-6-17(19)21(25)26/h2-9,16,24H,10-15H2,1H3,(H,25,26)