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

Systemtic Name: methyl 2-[4-oxidanylidene-6-[[4-(phenylmethyl)piperazin-1-yl]methyl]pyran-3-yl]oxyethanoate Openeye Name: methyl 2-[6-[(4-benzylpiperazin-1-yl)methyl]-4-oxo-pyran-3-yl]oxyacetate CAS Name: 2-[[4-oxo-6-[[4-(phenylmethyl)-1-piperazinyl]methyl]-3-pyranyl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[6-[(4-benzylpiperazin-1-yl)methyl]-4-oxopyran-3-yl]oxyacetate Traditional Name: 2-[6-[(4-benzylpiperazino)methyl]-4-keto-pyran-3-yl]oxyacetic acid methyl ester Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=COC(=CC1=O)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)COC1=COC(=CC1=O)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O5/c1-25-20(24)15-27-19-14-26-17(11-18(19)23)13-22-9-7-21(8-10-22)12-16-5-3-2-4-6-16/h2-6,11,14H,7-10,12-13,15H2,1H3