2-[3-[(E)-3-[6-methyl-2-oxidanyl-4-oxidanylidene-1-(2-oxidanylidenepropyl)pyridin-3-yl]-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[(E)-3-[6-methyl-2-oxidanyl-4-oxidanylidene-1-(2-oxidanylidenepropyl)pyridin-3-yl]-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile Openeye Name: 2-[3-[(E)-3-(1-acetonyl-2-hydroxy-6-methyl-4-oxo-3-pyridyl)-3-oxo-prop-1-enyl]phenoxy]acetonitrile CAS Name: 2-[3-[(E)-3-[2-hydroxy-6-methyl-4-oxo-1-(2-oxopropyl)-3-pyridinyl]-3-oxoprop-1-enyl]phenoxy]acetonitrile IUPAC Name: 2-[3-[(E)-3-[2-hydroxy-6-methyl-4-oxo-1-(2-oxopropyl)pyridin-3-yl]-3-oxoprop-1-enyl]phenoxy]acetonitrile Traditional Name: 2-[3-[(E)-3-(1-acetonyl-2-hydroxy-4-keto-6-methyl-3-pyridyl)-3-keto-prop-1-enyl]phenoxy]acetonitrile Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CC(=O)C)O)C(=O)C=CC2=CC(=CC=C2)OCC#N

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC(=O)C)O)C(=O)/C=C/C2=CC(=CC=C2)OCC#N

InChI

InChI=1S/C20H18N2O5/c1-13-10-18(25)19(20(26)22(13)12-14(2)23)17(24)7-6-15-4-3-5-16(11-15)27-9-8-21/h3-7,10-11,26H,9,12H2,1-2H3/b7-6+