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(3-Benzyloxy-phenyl)-(cyclobutanecarbonyl-amino)-acetic acid

HCID 68588161
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=C(NC(C(=O)O)c1cccc(OCc2ccccc2)c1)C1CCC1
InChIKey
VIANQRJNNAXVGZ-UHFFFAOYSA-N
Molecular formula
C20H21NO4
Average molar mass
339.4 g/mol

Names & identifiers

Preferred name
(3-Benzyloxy-phenyl)-(cyclobutanecarbonyl-amino)-acetic acid
IUPAC
2-(cyclobutanecarbonylamino)-2-(3-phenylmethoxyphenyl)acetic acid

Names & synonyms

SCHEMBL3303497VIANQRJNNAXVGZ-UHFFFAOYSA-N(3-benzyloxy-phenyl)-(cyclobutanecarbonyl-amino)-acetic acid

Database identifiers

PubChem CID
68588161

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
75.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
25
Formal charge
0
Complexity
457

Related reactions

1 records
New reaction record
HRID 17975 reaction equation
HRID 17975As reactantuspto-grants-2010_06

Compound notes

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