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

Systemtic Name: methyl 2-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]benzoate Openeye Name: methyl 2-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]benzoate CAS Name: 2-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]benzoic acid methyl ester IUPAC Name: methyl 2-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]benzoate Traditional Name: 2-[2-hydroxy-3-(4-phenylpiperazino)propoxy]benzoic acid methyl ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1OCC(CN2CCN(CC2)C3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C1=CC=CC=C1OCC(CN2CCN(CC2)C3=CC=CC=C3)O

InChI

InChI=1S/C21H26N2O4/c1-26-21(25)19-9-5-6-10-20(19)27-16-18(24)15-22-11-13-23(14-12-22)17-7-3-2-4-8-17/h2-10,18,24H,11-16H2,1H3