4-[bis(6-methyl-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[bis(6-methyl-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl)methyl]benzenecarbonitrile Openeye Name: 4-[bis(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)methyl]benzonitrile CAS Name: 4-[bis(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)methyl]benzonitrile IUPAC Name: 4-[bis(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)methyl]benzonitrile Traditional Name: 4-[bis(2-hydroxy-4-keto-6-methyl-1H-pyridin-3-yl)methyl]benzonitrile Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1)O)C(C2=CC=C(C=C2)C#N)C3=C(NC(=CC3=O)C)O

Isomeric SMILES

CC1=CC(=O)C(=C(N1)O)C(C2=CC=C(C=C2)C#N)C3=C(NC(=CC3=O)C)O

InChI

InChI=1S/C20H17N3O4/c1-10-7-14(24)17(19(26)22-10)16(13-5-3-12(9-21)4-6-13)18-15(25)8-11(2)23-20(18)27/h3-8,16H,1-2H3,(H2,22,24,26)(H2,23,25,27)