(E)-3-{1'-tert-butoxycarbonyl-4-oxo-spiro[chromane-2,4'-piperidine]-6-yl}-acrylic acid methyl ester

HCID 52952087
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Basic information

Standard SMILES
COC(=O)/C=C/c1ccc2c(c1)C(=O)CC1(CCN(C(=O)OC(C)(C)C)CC1)O2
InChIKey
SIAVOOUDCWMFSO-SOFGYWHQSA-N
Molecular formula
C22H27NO6
Average molar mass
401.5 g/mol

Names & identifiers

Preferred name
(E)-3-{1'-tert-butoxycarbonyl-4-oxo-spiro[chromane-2,4'-piperidine]-6-yl}-acrylic acid methyl ester
IUPAC
tert-butyl 6-[(E)-3-methoxy-3-oxoprop-1-enyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate

Names & synonyms

SCHEMBL1175943SIAVOOUDCWMFSO-SOFGYWHQSA-N(E)-3-{1'-tert-butoxycarbonyl-4-oxo-spiro[chromane-2,4'-piperidine]-6-yl}-acrylic acid methyl ester

Database identifiers

PubChem CID
52952087

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
82.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
29

Related reactions

63 records
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Compound notes

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