4-[(E)-3-oxidanyl-3-(1H-pyridin-4-ylidene)prop-1-enyl]cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 4-[(E)-3-oxidanyl-3-(1H-pyridin-4-ylidene)prop-1-enyl]cyclohexa-3,5-diene-1,2-dione Openeye Name: 4-[(E)-3-hydroxy-3-(1H-pyridin-4-ylidene)prop-1-enyl]-1,2-benzoquinone CAS Name: 4-[(E)-3-hydroxy-3-(1H-pyridin-4-ylidene)prop-1-enyl]cyclohexa-3,5-diene-1,2-dione IUPAC Name: 4-[(E)-3-hydroxy-3-(1H-pyridin-4-ylidene)prop-1-enyl]cyclohexa-3,5-diene-1,2-dione Traditional Name: 4-[(E)-3-hydroxy-3-(1H-pyridin-4-ylidene)prop-1-enyl]-o-benzoquinone Formula: C14H11NO3 MolecularWeight: 241.24204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=O)C=C1C=CC(=C2C=CNC=C2)O

Isomeric SMILES

C1=CC(=O)C(=O)C=C1/C=C/C(=C2C=CNC=C2)O

InChI

InChI=1S/C14H11NO3/c16-12(11-5-7-15-8-6-11)3-1-10-2-4-13(17)14(18)9-10/h1-9,15-16H/b3-1+