(phenylmethyl) 2-[4-oxidanylidene-6-[(4-phenylpiperazin-1-yl)methyl]pyran-3-yl]oxyethanoate

Systemtic Name: (phenylmethyl) 2-[4-oxidanylidene-6-[(4-phenylpiperazin-1-yl)methyl]pyran-3-yl]oxyethanoate Openeye Name: benzyl 2-[4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]pyran-3-yl]oxyacetate CAS Name: 2-[[4-oxo-6-[(4-phenyl-1-piperazinyl)methyl]-3-pyranyl]oxy]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-oxo-6-[(4-phenylpiperazin-1-yl)methyl]pyran-3-yl]oxyacetate Traditional Name: 2-[4-keto-6-[(4-phenylpiperazino)methyl]pyran-3-yl]oxyacetic acid benzyl ester Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)C(=CO2)OCC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)C(=CO2)OCC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O5/c28-23-15-22(16-26-11-13-27(14-12-26)21-9-5-2-6-10-21)30-18-24(23)31-19-25(29)32-17-20-7-3-1-4-8-20/h1-10,15,18H,11-14,16-17,19H2