Basic information
- Standard SMILES
C=COC(=O)NC1Cc2ccc(-c3ccc(=O)[nH]n3)cc2C1- InChIKey
DIMSAWWTWBVCLL-UHFFFAOYSA-N- Molecular formula
- C16H15N3O3
- Average molar mass
- 297.31 g/mol
- Monoisotopic mass
- 297.11134135
Names & identifiers
- Preferred name
- 2-vinyloxycarbonylamino-5-[pyridazin-3(2H)-on-6-yl]indane
- IUPAC
- ethenyl N-[5-(6-oxo-1H-pyridazin-3-yl)-2,3-dihydro-1H-inden-2-yl]carbamate
Names & synonyms
SCHEMBL8912517DIMSAWWTWBVCLL-UHFFFAOYSA-N2-vinyloxycarbonylamino-5-[pyridazin-3(2H)-on-6-yl]indane
Database identifiers
- PubChem CID
- 19972840
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 541
Related reactions
3 records
Compound notes
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