5-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethoxy]-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]pyran-4-one

Systemtic Name: 5-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethoxy]-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]pyran-4-one Openeye Name: 2-[(4-benzylpiperazin-1-yl)methyl]-5-[2-(4-methyl-1-piperidyl)-2-oxo-ethoxy]pyran-4-one CAS Name: 5-[2-(4-methyl-1-piperidinyl)-2-oxoethoxy]-2-[[4-(phenylmethyl)-1-piperazinyl]methyl]-4-pyranone IUPAC Name: 2-[(4-benzylpiperazin-1-yl)methyl]-5-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]pyran-4-one Traditional Name: 2-[(4-benzylpiperazino)methyl]-5-[2-keto-2-(4-methylpiperidino)ethoxy]pyran-4-one Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)COC2=COC(=CC2=O)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C(=O)COC2=COC(=CC2=O)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O4/c1-20-7-9-28(10-8-20)25(30)19-32-24-18-31-22(15-23(24)29)17-27-13-11-26(12-14-27)16-21-5-3-2-4-6-21/h2-6,15,18,20H,7-14,16-17,19H2,1H3