1-[(2S)-1-methoxypropan-2-yl]-5-(5-methyl-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[(2S)-1-methoxypropan-2-yl]-5-(5-methyl-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 5-(2-hydroxy-5-methyl-benzoyl)-1-[(1S)-2-methoxy-1-methyl-ethyl]-2-oxo-pyridine-3-carbonitrile CAS Name: 5-[(2-hydroxy-5-methylphenyl)-oxomethyl]-1-[(2S)-1-methoxypropan-2-yl]-2-oxo-3-pyridinecarbonitrile IUPAC Name: 5-(2-hydroxy-5-methylbenzoyl)-1-[(2S)-1-methoxypropan-2-yl]-2-oxopyridine-3-carbonitrile Traditional Name: 5-(2-hydroxy-5-methyl-benzoyl)-2-keto-1-[(1S)-2-methoxy-1-methyl-ethyl]nicotinonitrile Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)C2=CN(C(=O)C(=C2)C#N)C(C)COC

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)C2=CN(C(=O)C(=C2)C#N)[C@@H](C)COC

InChI

InChI=1S/C18H18N2O4/c1-11-4-5-16(21)15(6-11)17(22)14-7-13(8-19)18(23)20(9-14)12(2)10-24-3/h4-7,9,12,21H,10H2,1-3H3/t12-/m0/s1