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

Systemtic Name: ethyl 4-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]benzoate Openeye Name: ethyl 4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]benzoate CAS Name: 4-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]benzoate Traditional Name: 4-[2-hydroxy-3-(4-phenylpiperazino)propoxy]benzoic acid ethyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3)O

InChI

InChI=1S/C22H28N2O4/c1-2-27-22(26)18-8-10-21(11-9-18)28-17-20(25)16-23-12-14-24(15-13-23)19-6-4-3-5-7-19/h3-11,20,25H,2,12-17H2,1H3