Basic information
- Standard SMILES
CC[C@H](NC(=O)c1c(OCC(=O)O)c(-c2ccccc2)nc2ccccc12)c1ccccc1.Cl- InChIKey
RSBTWFTXHWRIOQ-BOXHHOBZSA-N- Molecular formula
- C27H25ClN2O4
- Average molar mass
- 476.9 g/mol
Names & identifiers
- Preferred name
- (S)-N-(alpha-ethylbenzyl)-3-(carboxymethoxy)-2-phenylquinoline-4-carboxamide hydrochloride
- IUPAC
- 2-[2-phenyl-4-[[(1S)-1-phenylpropyl]carbamoyl]quinolin-3-yl]oxyacetic acid;hydrochloride
Names & synonyms
SCHEMBL6208047RSBTWFTXHWRIOQ-BOXHHOBZSA-N(S)-N-(alpha-ethylbenzyl)-3-(carboxymethoxy)-2-phenylquinoline-4-carboxamide hydrochloride
Database identifiers
- PubChem CID
- 9891183
Properties
Computed structural properties
- Topological polar surface area
- 88.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 644
Related reactions
1 records
Compound notes
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