2-(Carboxymethyl-amino)-6-chloro-quinoline-3-carboxylic acid

HCID 67358680
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Basic information

Standard SMILES
O=C(O)CNc1nc2ccc(Cl)cc2cc1C(=O)O
InChIKey
YNGZZNNAMZJXPU-UHFFFAOYSA-N
Molecular formula
C12H9ClN2O4
Average molar mass
280.66 g/mol
Monoisotopic mass
280.0250845

Names & identifiers

Preferred name
2-(Carboxymethyl-amino)-6-chloro-quinoline-3-carboxylic acid
IUPAC
2-(carboxymethylamino)-6-chloroquinoline-3-carboxylic acid

Names & synonyms

SCHEMBL2309761YNGZZNNAMZJXPU-UHFFFAOYSA-N2-(Carboxymethyl-amino)-6-chloro-quinoline-3-carboxylic acid

Database identifiers

PubChem CID
67358680

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
99.5 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
19

Related reactions

1 records
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Compound notes

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