11-[1,1-dimethylethyl]-9-oxo-2,3,6,7-tetrahydro-1H,5H-[1]benzopyrano[6,7,8-ij]quinolizine

HCID 19783683
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Basic information

Standard SMILES
CC(C)(C)c1cc(=O)c2cc3c4c(c2o1)CCCN4CCC3
InChIKey
DEYGKLQKPCICNT-UHFFFAOYSA-N
Molecular formula
C19H23NO2
Average molar mass
297.4 g/mol

Names & identifiers

Preferred name
11-[1,1-dimethylethyl]-9-oxo-2,3,6,7-tetrahydro-1H,5H-[1]benzopyrano[6,7,8-ij]quinolizine
IUPAC
4-tert-butyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),4,8-tetraen-6-one

Names & synonyms

SCHEMBL9557230DEYGKLQKPCICNT-UHFFFAOYSA-N11-[1,1-dimethylethyl]-9-oxo-2,3,6,7-tetrahydro-1H,5H-[1]benzopyrano[6,7,8-ij]quinolizine

Database identifiers

PubChem CID
19783683

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
22

Related reactions

2 records
New reaction record

Compound notes

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