4-(Aminocarbonyl)-2-methyl-5-[(1-methylpropyl)oxy]benzoic acid

HCID 57748396
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Basic information

Standard SMILES
CCC(C)Oc1cc(C(=O)O)c(C)cc1C(N)=O
InChIKey
RAFLPLDNSIPSAQ-UHFFFAOYSA-N
Molecular formula
C13H17NO4
Average molar mass
251.28 g/mol

Names & identifiers

Preferred name
4-(Aminocarbonyl)-2-methyl-5-[(1-methylpropyl)oxy]benzoic acid
IUPAC
5-butan-2-yloxy-4-carbamoyl-2-methylbenzoic acid

Names & synonyms

4-(aminocarbonyl)-2-methyl-5-[(1-methylpropyl)oxy]benzoic acid1149387-30-3SCHEMBL2430277RAFLPLDNSIPSAQ-UHFFFAOYSA-NDB-348732

Database identifiers

PubChem CID
57748396

Properties

Computed structural properties

XLogP
2
Topological polar surface area
89.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
18

Related reactions

1 records
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Compound notes

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