Basic information
- Standard SMILES
O=C(O)/C=C/c1cnc2c(c1)OCC(=O)N2- InChIKey
VJKZXIHGOUCXJV-OWOJBTEDSA-N- Molecular formula
- C10H8N2O4
- Average molar mass
- 220.18 g/mol
- Monoisotopic mass
- 220.04840674
Names & identifiers
- Preferred name
- (E)-3-(3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-7-yl)acrylic acid
- IUPAC
- (E)-3-(3-oxo-4H-pyrido[3,2-b][1,4]oxazin-7-yl)prop-2-enoic acid
Names & synonyms
SCHEMBL1253519VJKZXIHGOUCXJV-OWOJBTEDSA-N(E)-3-(3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-7-yl)acrylic acid
Database identifiers
- PubChem CID
- 57742058
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 88.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 329
Related reactions
8 records
Compound notes
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