Basic information
- Standard SMILES
CCOC(=O)N1c2cc(OC)c(OCc3ccccc3)cc2C(=NO)CC1C- InChIKey
AKPNJOAFAQNNRE-UHFFFAOYSA-N- Molecular formula
- C21H24N2O5
- Average molar mass
- 384.4 g/mol
- Monoisotopic mass
- 384.16852187
Names & identifiers
- Preferred name
- 6-Benzyloxy-4-hydroxyimino-7-methoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid ethyl ester
- IUPAC
- ethyl 4-hydroxyimino-7-methoxy-2-methyl-6-phenylmethoxy-2,3-dihydroquinoline-1-carboxylate
Names & synonyms
SCHEMBL6590556AKPNJOAFAQNNRE-UHFFFAOYSA-N6-Benzyloxy-4-hydroxyimino-7-methoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 86755993
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 549
Related reactions
5 records
Compound notes
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