3-(3-methylbutanoyl)-4-oxidanyl-1-(phenylmethyl)-2-pyridin-3-yl-2H-pyrrol-5-one

Systemtic Name: 3-(3-methylbutanoyl)-4-oxidanyl-1-(phenylmethyl)-2-pyridin-3-yl-2H-pyrrol-5-one Openeye Name: 1-benzyl-4-hydroxy-3-(3-methylbutanoyl)-2-(3-pyridyl)-2H-pyrrol-5-one CAS Name: 4-hydroxy-3-(3-methyl-1-oxobutyl)-1-(phenylmethyl)-2-(3-pyridinyl)-2H-pyrrol-5-one IUPAC Name: 1-benzyl-4-hydroxy-3-(3-methylbutanoyl)-2-pyridin-3-yl-2H-pyrrol-5-one Traditional Name: 1-benzyl-3-hydroxy-4-isovaleryl-5-(3-pyridyl)-3-pyrrolin-2-one Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=C(C(=O)N(C1C2=CN=CC=C2)CC3=CC=CC=C3)O

Isomeric SMILES

CC(C)CC(=O)C1=C(C(=O)N(C1C2=CN=CC=C2)CC3=CC=CC=C3)O

InChI

InChI=1S/C21H22N2O3/c1-14(2)11-17(24)18-19(16-9-6-10-22-12-16)23(21(26)20(18)25)13-15-7-4-3-5-8-15/h3-10,12,14,19,25H,11,13H2,1-2H3