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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=O)C(=C1)C=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(10-6-8-15-9-7-10)5-4-11-2-1-3-13(17)14(11)18/h1-9,15-16H/b5-4+