6-methyl-3-oxidanyl-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]pyran-4-one

Systemtic Name: 6-methyl-3-oxidanyl-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]pyran-4-one Openeye Name: 2-[(4-benzylpiperazin-1-yl)methyl]-3-hydroxy-6-methyl-pyran-4-one CAS Name: 3-hydroxy-6-methyl-2-[[4-(phenylmethyl)-1-piperazinyl]methyl]-4-pyranone IUPAC Name: 2-[(4-benzylpiperazin-1-yl)methyl]-3-hydroxy-6-methylpyran-4-one Traditional Name: 2-[(4-benzylpiperazino)methyl]-3-hydroxy-6-methyl-pyran-4-one Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)CN2CCN(CC2)CC3=CC=CC=C3)O

Isomeric SMILES

CC1=CC(=O)C(=C(O1)CN2CCN(CC2)CC3=CC=CC=C3)O

InChI

InChI=1S/C18H22N2O3/c1-14-11-16(21)18(22)17(23-14)13-20-9-7-19(8-10-20)12-15-5-3-2-4-6-15/h2-6,11,22H,7-10,12-13H2,1H3