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

Systemtic Name: 2-[4-[(E)-3-(6-methyl-2-oxidanyl-4-oxidanylidene-pyran-3-yl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(2-hydroxy-6-methyl-4-oxo-pyran-3-yl)-3-oxo-prop-1-enyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(2-hydroxy-6-methyl-4-oxo-3-pyranyl)-3-oxoprop-1-enyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(2-hydroxy-6-methyl-4-oxopyran-3-yl)-3-oxoprop-1-enyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(2-hydroxy-4-keto-6-methyl-pyran-3-yl)-3-keto-prop-1-enyl]phenoxy]acetonitrile Formula: C17H13NO5 MolecularWeight: 311.28882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)C=CC2=CC=C(C=C2)OCC#N

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=CC=C(C=C2)OCC#N

InChI

InChI=1S/C17H13NO5/c1-11-10-15(20)16(17(21)23-11)14(19)7-4-12-2-5-13(6-3-12)22-9-8-18/h2-7,10,21H,9H2,1H3/b7-4+