6-[3-(hydroxymethyl)-3-(2-phenoxyethyl)piperidin-1-yl]carbonyl-2,2-dimethyl-3H-pyran-4-one

Systemtic Name: 6-[3-(hydroxymethyl)-3-(2-phenoxyethyl)piperidin-1-yl]carbonyl-2,2-dimethyl-3H-pyran-4-one Openeye Name: 6-[3-(hydroxymethyl)-3-(2-phenoxyethyl)piperidine-1-carbonyl]-2,2-dimethyl-3H-pyran-4-one CAS Name: 6-[[3-(hydroxymethyl)-3-(2-phenoxyethyl)-1-piperidinyl]-oxomethyl]-2,2-dimethyl-3H-pyran-4-one IUPAC Name: 6-[3-(hydroxymethyl)-3-(2-phenoxyethyl)piperidine-1-carbonyl]-2,2-dimethyl-3H-pyran-4-one Traditional Name: 2,2-dimethyl-6-[3-methylol-3-(2-phenoxyethyl)piperidine-1-carbonyl]-3H-pyran-4-one Formula: C22H29NO5 MolecularWeight: 387.46936

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C=C(O1)C(=O)N2CCCC(C2)(CCOC3=CC=CC=C3)CO)C

Isomeric SMILES

CC1(CC(=O)C=C(O1)C(=O)N2CCCC(C2)(CCOC3=CC=CC=C3)CO)C

InChI

InChI=1S/C22H29NO5/c1-21(2)14-17(25)13-19(28-21)20(26)23-11-6-9-22(15-23,16-24)10-12-27-18-7-4-3-5-8-18/h3-5,7-8,13,24H,6,9-12,14-16H2,1-2H3