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

Systemtic Name: 3-[3-[(E)-3-(6-methyl-2-oxidanyl-4-oxidanylidene-pyran-3-yl)-3-oxidanylidene-prop-1-enyl]phenyl]propanenitrile Openeye Name: 3-[3-[(E)-3-(2-hydroxy-6-methyl-4-oxo-pyran-3-yl)-3-oxo-prop-1-enyl]phenyl]propanenitrile CAS Name: 3-[3-[(E)-3-(2-hydroxy-6-methyl-4-oxo-3-pyranyl)-3-oxoprop-1-enyl]phenyl]propanenitrile IUPAC Name: 3-[3-[(E)-3-(2-hydroxy-6-methyl-4-oxopyran-3-yl)-3-oxoprop-1-enyl]phenyl]propanenitrile Traditional Name: 3-[3-[(E)-3-(2-hydroxy-4-keto-6-methyl-pyran-3-yl)-3-keto-prop-1-enyl]phenyl]propionitrile Formula: C18H15NO4 MolecularWeight: 309.316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO4/c1-12-10-16(21)17(18(22)23-12)15(20)8-7-14-5-2-4-13(11-14)6-3-9-19/h2,4-5,7-8,10-11,22H,3,6H2,1H3/b8-7+