Coumarine 3-carboxamide, N-metoxycarbonylmethyl-

HCID 599285
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Basic information

Standard SMILES
COC(=O)CNC(=O)c1cc2ccccc2oc1=O
InChIKey
NIZGGTYDRTZADN-UHFFFAOYSA-N
Molecular formula
C13H11NO5
Average molar mass
261.23 g/mol

Names & identifiers

Preferred name
Coumarine 3-carboxamide, N-metoxycarbonylmethyl-
IUPAC
methyl 2-[(2-oxochromene-3-carbonyl)amino]acetate

Names & synonyms

CBDivE_006606SCHEMBL3045340AKOS008934319Coumarine 3-carboxamide, N-metoxycarbonylmethyl-coumarin-3-carbonylamino-acetic Acid Methyl Estermethyl N-[(2-oxo-2H-chromen-3-yl)carbonyl]glycinateMethyl ([(2-oxo-2H-chromen-3-yl)carbonyl]amino)acetate #

Database identifiers

PubChem CID
599285
Nikkaji
J2.222.048I

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
81.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
19

Related reactions

5 records
New reaction record

Compound notes

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