ethyl 4-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoate

Systemtic Name: ethyl 4-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoate Openeye Name: ethyl 4-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-hydroxy-propoxy]benzoate CAS Name: 4-[3-[4-(2-ethoxyphenyl)-1-piperazinyl]-2-hydroxypropoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-hydroxypropoxy]benzoate Traditional Name: 4-[2-hydroxy-3-(4-o-phenetylpiperazino)propoxy]benzoic acid ethyl ester Formula: C24H32N2O5 MolecularWeight: 428.52128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C(=O)OCC)O

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C(=O)OCC)O

InChI

InChI=1S/C24H32N2O5/c1-3-29-23-8-6-5-7-22(23)26-15-13-25(14-16-26)17-20(27)18-31-21-11-9-19(10-12-21)24(28)30-4-2/h5-12,20,27H,3-4,13-18H2,1-2H3