6-methyl-4-oxidanylidene-3-[(E)-3-pyridin-3-ylprop-2-enoyl]pyran-2-olate

Systemtic Name: 6-methyl-4-oxidanylidene-3-[(E)-3-pyridin-3-ylprop-2-enoyl]pyran-2-olate Openeye Name: 6-methyl-4-oxo-3-[(E)-3-(3-pyridyl)prop-2-enoyl]pyran-2-olate CAS Name: 6-methyl-4-oxo-3-[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]-2-pyranolate IUPAC Name: 6-methyl-4-oxo-3-[(E)-3-pyridin-3-ylprop-2-enoyl]pyran-2-olate Traditional Name: 4-keto-6-methyl-3-[(E)-3-(3-pyridyl)acryloyl]pyran-2-olate Formula: C14H10NO4- MolecularWeight: 256.2335

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)[O-])C(=O)C=CC2=CN=CC=C2

Isomeric SMILES

CC1=CC(=O)C(=C(O1)[O-])C(=O)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C14H11NO4/c1-9-7-12(17)13(14(18)19-9)11(16)5-4-10-3-2-6-15-8-10/h2-8,18H,1H3/p-1/b5-4+