Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)carbonyl)amino)-, 1-cyclopropylethyl ester
Basic information
- CAS
178869-95-9- Standard SMILES
Cc1occc1C(=O)Nc1ccc(Cl)c(C(=O)OC(C)C2CC2)c1- InChIKey
HBGKPUISHSIPDD-UHFFFAOYSA-N- Molecular formula
- C18H18ClNO4
- Average molar mass
- 347.8 g/mol
- Monoisotopic mass
- 347.0924357
Names & identifiers
- Preferred name
- Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)carbonyl)amino)-, 1-cyclopropylethyl ester
- IUPAC
- 1-cyclopropylethyl 2-chloro-5-[(2-methylfuran-3-carbonyl)amino]benzoate
Names & synonyms
178869-95-9Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)carbonyl)amino)-, 1-cyclopropylethyl esterBenzoic acid, 2-chloro-5-[[(2-methyl-3-furanyl)carbonyl]amino]-, 1-cyclopropylethyl esterDTXSID409391231-cyclopropylethyl 2-chloro-5-[(2-methylfuran-3-carbonyl)amino]benzoateN-{4-Chloro-3-[(1-cyclopropylethoxy)carbonyl]phenyl}-2-methylfuran-3-carboximidic acid
Database identifiers
- CAS
178869-95-9- PubChem CID
- 461735
- DTXSID
DTXSID40939123
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 482
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Compound notes
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