methyl 4-(2-oxo-2H-chromene-3-amido)benzoate
Basic information
- CAS
302558-76-5- Standard SMILES
COC(=O)c1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1- InChIKey
QHSGHJVWAPOTSV-UHFFFAOYSA-N- Molecular formula
- C18H13NO5
- Average molar mass
- 323.3 g/mol
- Monoisotopic mass
- 323.07937252
Names & identifiers
- Preferred name
- methyl 4-(2-oxo-2H-chromene-3-amido)benzoate
- IUPAC
- methyl 4-[(2-oxochromene-3-carbonyl)amino]benzoate
Names & synonyms
302558-76-5methyl 4-(2-oxo-2H-chromene-3-amido)benzoatemethyl 4-[(2-oxochromene-3-carbonyl)amino]benzoateMethyl 4-(2-oxo-2h-chromene-3-carboxamido)benzoatemethyl 4-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}benzoateOprea1_108273Oprea1_585124DTXSID50350461STK701676AKOS000536642CS-0301914ST45188023
Show more names
ST50330864AE-641/10071027F094174METHYL 4-(2-OXOCHROMENE-3-AMIDO)BENZOATESR-01000404512SR-01000404512-1methyl 4-[(2-oxochromen-3-yl)carbonylamino]benzoateZ28226479
Database identifiers
- CAS
302558-76-5- PubChem CID
- 679733
- DTXSID
DTXSID50350461
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 81.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 548
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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