1,3,4,9-Tetrahydro-1,1-diethyl-6-(phenylmethoxy)pyrano[3,4-b]indole

HCID 19935702
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCC1(CC)OCCc2c1[nH]c1ccc(OCc3ccccc3)cc21
InChIKey
GOEVFQXAYGCTOK-UHFFFAOYSA-N
Molecular formula
C22H25NO2
Average molar mass
335.4 g/mol

Names & identifiers

Preferred name
1,3,4,9-Tetrahydro-1,1-diethyl-6-(phenylmethoxy)pyrano[3,4-b]indole
IUPAC
1,1-diethyl-6-phenylmethoxy-4,9-dihydro-3H-pyrano[3,4-b]indole

Names & synonyms

SCHEMBL9139209GOEVFQXAYGCTOK-UHFFFAOYSA-N1,3,4,9-tetrahydro-1,1-diethyl-6-(phenylmethoxy)pyrano[3,4-b]indole

Database identifiers

PubChem CID
19935702

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
34.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
25

Related reactions

5 records
New reaction record

Compound notes

Loading…