5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-1-(3-methoxypropyl)-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-1-(3-methoxypropyl)-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 5-(2-hydroxy-5-methoxy-benzoyl)-1-(3-methoxypropyl)-2-oxo-pyridine-3-carbonitrile CAS Name: 5-[(2-hydroxy-5-methoxyphenyl)-oxomethyl]-1-(3-methoxypropyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 5-(2-hydroxy-5-methoxybenzoyl)-1-(3-methoxypropyl)-2-oxopyridine-3-carbonitrile Traditional Name: 5-(2-hydroxy-5-methoxy-benzoyl)-2-keto-1-(3-methoxypropyl)nicotinonitrile Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)OC)O

Isomeric SMILES

COCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)OC)O

InChI

InChI=1S/C18H18N2O5/c1-24-7-3-6-20-11-13(8-12(10-19)18(20)23)17(22)15-9-14(25-2)4-5-16(15)21/h4-5,8-9,11,21H,3,6-7H2,1-2H3