Basic information
- Standard SMILES
CCOC(=O)C1(NC(=O)c2c(C)cccc2Cl)Cc2ccccc2C1- InChIKey
FJQQHUTZGAMBSJ-UHFFFAOYSA-N- Molecular formula
- C20H20ClNO3
- Average molar mass
- 357.8 g/mol
Names & identifiers
- Preferred name
- 2-(2-Chloro-6-methyl-benzoylamino)-indane-2-carboxylic acid ethyl ester
- IUPAC
- ethyl 2-[(2-chloro-6-methylbenzoyl)amino]-1,3-dihydroindene-2-carboxylate
Names & synonyms
SCHEMBL3307676FJQQHUTZGAMBSJ-UHFFFAOYSA-N2-(2-chloro-6-methyl-benzoylamino)-indane-2-carboxylic acid ethyl ester2-[(2-Chloro-6-methyl-benzoyl)-amino]-indane-2-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 59314271
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 495
Related reactions
4 records
Compound notes
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