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Methyl 7-methoxy-2-oxo-1-(2-oxoethyl)-1,2-dihydroquinoline-4-carboxylate

HCID 59397992
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)c1cc(=O)n(CC=O)c2cc(OC)ccc12
InChIKey
WUCWNDGOWXJGDU-UHFFFAOYSA-N
Molecular formula
C14H13NO5
Average molar mass
275.26 g/mol

Names & identifiers

Preferred name
Methyl 7-methoxy-2-oxo-1-(2-oxoethyl)-1,2-dihydroquinoline-4-carboxylate
IUPAC
methyl 7-methoxy-2-oxo-1-(2-oxoethyl)quinoline-4-carboxylate

Names & synonyms

SCHEMBL2796705WUCWNDGOWXJGDU-UHFFFAOYSA-Nmethyl 7-methoxy-2-oxo-1-(2-oxoethyl)-1,2-dihydroquinoline-4-carboxylate

Database identifiers

PubChem CID
59397992

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
72.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
20
Formal charge
0
Complexity
445

Related reactions

7 records
New reaction record
HRID 39767 reaction equation
HRID 39767As productuspto-grants-2013_09
HRID 39768 reaction equation
HRID 39768As reactantuspto-grants-2013_09
HRID 39870 reaction equation
HRID 39870As reactantuspto-grants-2013_09
HRID 101418 reaction equation
HRID 101418As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 823318 reaction equation
HRID 823318As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 958794 reaction equation
HRID 958794As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 2193244 reaction equation
HRID 2193244As reactantuspto-grants-2012_12

Compound notes

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