7-oxidanylidene-2-[(E)-3-pyridin-3-ylprop-2-enoyl]cyclohepta-1,3,5-trien-1-olate

Systemtic Name: 7-oxidanylidene-2-[(E)-3-pyridin-3-ylprop-2-enoyl]cyclohepta-1,3,5-trien-1-olate Openeye Name: 7-oxo-2-[(E)-3-(3-pyridyl)prop-2-enoyl]cyclohepta-1,3,5-trien-1-olate CAS Name: 7-oxo-2-[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]-1-cyclohepta-1,3,5-trienolate IUPAC Name: 7-oxo-2-[(E)-3-pyridin-3-ylprop-2-enoyl]cyclohepta-1,3,5-trien-1-olate Traditional Name: 7-keto-2-[(E)-3-(3-pyridyl)acryloyl]cyclohepta-1,3,5-trien-1-olate Formula: C15H10NO3- MolecularWeight: 252.2448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=O)C=C1)[O-])C(=O)C=CC2=CN=CC=C2

Isomeric SMILES

C1=CC(=C(C(=O)C=C1)[O-])C(=O)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C15H11NO3/c17-13(8-7-11-4-3-9-16-10-11)12-5-1-2-6-14(18)15(12)19/h1-10H,(H,18,19)/p-1/b8-7+