1-(cyclohexylmethyl)-2-(methoxymethyl)-6-methyl-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-pyridin-4-one

Systemtic Name: 1-(cyclohexylmethyl)-2-(methoxymethyl)-6-methyl-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-pyridin-4-one Openeye Name: 3-(4-benzylpiperazine-1-carbonyl)-1-(cyclohexylmethyl)-2-(methoxymethyl)-6-methyl-pyridin-4-one CAS Name: 1-(cyclohexylmethyl)-2-(methoxymethyl)-6-methyl-3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-4-pyridinone IUPAC Name: 3-(4-benzylpiperazine-1-carbonyl)-1-(cyclohexylmethyl)-2-(methoxymethyl)-6-methylpyridin-4-one Traditional Name: 3-(4-benzylpiperazine-1-carbonyl)-1-(cyclohexylmethyl)-2-(methoxymethyl)-6-methyl-4-pyridone Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CC2CCCCC2)COC)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC2CCCCC2)COC)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H37N3O3/c1-21-17-25(31)26(24(20-33-2)30(21)19-23-11-7-4-8-12-23)27(32)29-15-13-28(14-16-29)18-22-9-5-3-6-10-22/h3,5-6,9-10,17,23H,4,7-8,11-16,18-20H2,1-2H3